A0A087XW81_POEFO Loading...

Ankyrin repeat and SOCS box containing 2

AlphaFold DB , UniProt , Accession A0A087XW81, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 642 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	27.5	Very low	26.3	Very low	245 Å²	245	138 Å²	138	100%	1.207	88%	0.882	S	S	*	*				0	155.2	0	-67.8	-167.5	-160.5	0	0	109.2
2	A	26.2	Very low	26.1	Very low	104 Å²	104	133.9 Å²	133.9	86%	0.86	89%	0.885	S	S	*	*			trans	62.2	76.4	173.3	0	0	0	0	0	116.8
3	S	22.9	Very low	26	Very low	131 Å²	131	129.1 Å²	129.1	92%	0.916	87%	0.873	S	S	*	*	P	Polyproline II helix	trans	-86	128.6	154.3	-62.3	0	0	0	0	109.1
4	A	26.5	Very low	25.9	Very low	102 Å²	102	128.9 Å²	128.9	84%	0.843	87%	0.874	S	S	*	*	P	Polyproline II helix	trans	-101.5	141.4	173.8	0	0	0	0	0	110.9
5	S	26.6	Very low	25.8	Very low	122 Å²	122	125.9 Å²	125.9	85%	0.853	87%	0.873	S	S	*	*	P	Polyproline II helix	trans	-79.5	143.8	-177	40.9	0	0	0	0	112.8
6	V	27.4	Very low	25.8	Very low	131 Å²	131	123 Å²	123	79%	0.794	87%	0.87	S	S	*	*			trans	-128.8	129.2	165.5	178.7	0	0	0	0	109
7	S	25.7	Very low	25.9	Very low	116 Å²	116	122.1 Å²	122.1	81%	0.811	86%	0.863	S	S	*	*	P	Polyproline II helix	trans	-73.9	141	-169.4	-47.7	0	0	0	0	113.5
8	R	26.5	Very low	25.9	Very low	235 Å²	235	120.9 Å²	120.9	89%	0.887	86%	0.862	S	S	*	*	P	Polyproline II helix	trans	-95.2	141.6	163.8	-81.3	-179.2	163.8	-175.4	-6.3	110.8
9	P	28.1	Very low	26.2	Very low	127 Å²	127	122.7 Å²	122.7	83%	0.825	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-74	150.6	158.7	33.2	-32.2	0	0	0	109.9
10	G	24.5	Very low	26.3	Very low	83 Å²	83	121.3 Å²	121.3	86%	0.856	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-89.9	155.5	-167.4	0	0	0	0	0	115.9
11	S	26.9	Very low	26.5	Very low	122 Å²	122	124.9 Å²	124.9	85%	0.853	86%	0.855	S	S	*	*			trans	-149.8	129.8	155.1	51.7	0	0	0	0	107.2
12	G	24.3	Very low	26.7	Very low	89 Å²	89	122 Å²	122	92%	0.918	84%	0.839	S	S	*	*			trans	-82.4	155.1	-171.8	0	0	0	0	0	114.1
13	G	24.4	Very low	27	Very low	71 Å²	71	122.9 Å²	122.9	73%	0.732	83%	0.829	S	S	*	*			trans	166.5	89.9	176.5	0	0	0	0	0	113.9
14	S	25.2	Very low	27.7	Very low	126 Å²	126	126.4 Å²	126.4	88%	0.881	82%	0.824	S	S	*	*			trans	24.5	122.4	155.7	59	0	0	0	0	121.9
15	G	24.7	Very low	28.5	Very low	84 Å²	84	126.4 Å²	126.4	87%	0.866	82%	0.818	S	S	*	*				107.7	136.3	129.7	0	0	0	0	0	118.5
16	G	25.2	Very low	29.5	Very low	80 Å²	80	126.9 Å²	126.9	83%	0.825	81%	0.81	S	S	*	*			trans	92.1	95.6	157.9	0	0	0	0	0	116.5	A18	G16-A18 PolarHBondContact O-N 2.63Å
17	S	27.8	Very low	30.8	Very low	107 Å²	107	124.1 Å²	124.1	75%	0.748	79%	0.785	S	S	*	*			trans	-64.3	114.1	167.6	158.2	0	0	0	0	111.2
18	A	26.1	Very low	32	Very low	101 Å²	101	122.5 Å²	122.5	84%	0.835	77%	0.774	S	S	*	*			trans	-94.8	100.9	164.7	0	0	0	0	0	109.4	G16	G16-A18 PolarHBondContact O-N 2.63Å
19	L	30.7	Very low	33.4	Very low	156 Å²	156	118.8 Å²	118.8	82%	0.817	77%	0.772	S	S	*	*			trans	-85.8	143.7	171.6	-78.2	168.6	0	0	0	110.7
20	A	28.4	Very low	35.2	Very low	93 Å²	93	116 Å²	116	77%	0.769	75%	0.75	S	S	*	*			trans	-77.5	141.7	-172.6	0	0	0	0	0	112.7	E22	A20-E22 PolarHBondContact O-N 3.32Å
21	F	30.7	Very low	37.5	Very low	198 Å²	198	115.9 Å²	115.9	87%	0.868	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	94.9	169.9	-90.1	-107	0	0	0	110.2
22	E	31.2	Very low	39.1	Very low	185 Å²	185	116.7 Å²	116.7	86%	0.864	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-153.4	-19.5	164.1	-118	160.5	-146.5	0	0	115.3	A20	A20-E22 PolarHBondContact O-N 3.32Å
23	D	32.8	Very low	41.1	Very low	121 Å²	121	118.5 Å²	118.5	65%	0.647	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-86.7	-3.9	-172.5	-77.1	-26.4	0	0	0	117	S25 L26	D23-S25 PolarHBondContact O-N 3.29Å; D23-L26 PolarHBondContact O-N 3.08Å
24	Y	38.3	Very low	43.1	Very low	206 Å²	206	119.6 Å²	119.6	81%	0.808	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-68.4	-8.3	-170.5	-101.5	-81.9	0	0	0	115.8
25	S	44.3	Very low	44.9	Very low	102 Å²	102	116.5 Å²	116.5	71%	0.713	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-80.3	-13.5	-180	-170.3	0	0	0	0	114.6	D23 S28	D23-S25 PolarHBondContact O-N 3.29Å; S25-S28 PolarHBondContact O-OG 3.49Å; S25-S28 VanDerWaalsContact O-OG 3.09Å
26	L	46.8	Very low	46.9	Very low	131 Å²	131	117.5 Å²	117.5	69%	0.686	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-83.4	-16.7	-173.2	-82.9	162.4	0	0	0	114.6	D23	D23-L26 PolarHBondContact O-N 3.08Å
27	Y	54.5	Low	48.9	Very low	73 Å²	73	119.5 Å²	119.5	29%	0.286	65%	0.648	S	S	.	*	S	Bend	trans	-110.6	-0.7	-171.1	-56	-60	0	0	0	113.8	N29 L30 L38 R42	Y27-N29 PolarHBondContact O-N 2.95Å; Y27-L30 HydrophobicContact CD1-CD1 4.02Å; Y27-L30 PolarHBondContact O-N 3.44Å; Y27-L38 HydrophobicContact CD1-CD2 3.99Å; Y27-L38 HydrophobicContact CE1-CD2 3.52Å; Y27-R42 PolarHBondContact OH-NH1 2.89Å; Y27-R42 VanDerWaalsContact OH-NH1 3.09Å; Y27-R42 PolarHBondContact OH-NH2 2.85Å
28	S	50.5	Low	51.1	Low	82 Å²	82	117.1 Å²	117.1	57%	0.573	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.9	-20.5	-173.9	-35.6	0	0	0	0	115.6	S25	S25-S28 PolarHBondContact O-OG 3.49Å; S25-S28 VanDerWaalsContact O-OG 3.09Å
29	N	55.3	Low	52.9	Low	158 Å²	158	115 Å²	115	85%	0.845	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.5	5.7	-170.4	-61	-16.4	0	0	0	113.2	Y27	Y27-N29 PolarHBondContact O-N 2.95Å
30	L	67.1	Low	54.7	Low	67 Å²	67	111.6 Å²	111.6	35%	0.351	59%	0.591	S	S	.	*			trans	-93.8	146	178.5	-63.4	177.4	0	0	0	110.7	Y27 E34 L35	Y27-L30 HydrophobicContact CD1-CD1 4.02Å; Y27-L30 PolarHBondContact O-N 3.44Å; L30-E34 HydrophobicContact CB-CB 4.19Å; L30-E34 HydrophobicContact CD2-CB 4.31Å; L30-L35 HydrophobicContact CB-CD2 3.95Å; L30-L35 HydrophobicContact CB-CG 3.98Å; L30-L35 HydrophobicContact CD1-CD2 3.92Å
31	T	72.4	Confident	56.6	Low	82 Å²	82	112.5 Å²	112.5	50%	0.503	58%	0.579	S	S	.	*			trans	-77.2	160.4	172.2	59.8	0	0	0	0	111.6	D33 E34 L35	T31-D33 PolarHBondContact O-N 2.94Å; T31-E34 WeakPolarHBondContact CB-OE2 3.39Å; T31-E34 PolarHBondContact N-OE2 3.49Å; T31-E34 PolarHBondContact O-N 2.89Å; T31-E34 VanDerWaalsContact OG1-CD 3.29Å; T31-E34 WeakPolarHBondContact OG1-CG 3.17Å; T31-E34 PolarHBondContact OG1-OE2 3.23Å; T31-L35 WeakPolarHBondContact O-CG 3.35Å; T31-L35 PolarHBondContact O-N 3.42Å
32	D	61.1	Low	57.9	Low	138 Å²	138	109.6 Å²	109.6	74%	0.738	56%	0.563	S	S	*	*	H	α-helix	trans	-58.1	-34.6	-178	-67.9	-28.6	0	0	0	112.7	L35 L36	D32-L35 PolarHBondContact O-N 3.47Å; D32-L36 WeakPolarHBondContact O-CB 3.46Å; D32-L36 PolarHBondContact O-N 3.3Å
33	D	64.9	Low	59.4	Low	127 Å²	127	103.9 Å²	103.9	68%	0.679	54%	0.543	S	S	*	.	H	α-helix	trans	-69.3	-38.5	175.5	-72.3	-29.2	0	0	0	112.2	T31 L36 Q37	T31-D33 PolarHBondContact O-N 2.94Å; D33-L36 PolarHBondContact O-N 3.2Å; D33-Q37 WeakPolarHBondContact O-CB 3.45Å; D33-Q37 PolarHBondContact O-N 3.34Å
34	E	67.6	Low	60.5	Low	94 Å²	94	102.8 Å²	102.8	44%	0.439	54%	0.536	S	S	.	.	H	α-helix	trans	-68.8	-36.3	175.4	-69.7	166.9	128.6	0	0	111.7	L30 T31 Q37 L38	L30-E34 HydrophobicContact CB-CB 4.19Å; L30-E34 HydrophobicContact CD2-CB 4.31Å; T31-E34 WeakPolarHBondContact CB-OE2 3.39Å; T31-E34 PolarHBondContact N-OE2 3.49Å; T31-E34 PolarHBondContact O-N 2.89Å; T31-E34 VanDerWaalsContact OG1-CD 3.29Å; T31-E34 WeakPolarHBondContact OG1-CG 3.17Å; T31-E34 PolarHBondContact OG1-OE2 3.23Å; E34-Q37 PolarHBondContact O-N 2.86Å; E34-L38 WeakPolarHBondContact O-CB 3.41Å; E34-L38 PolarHBondContact O-N 2.82Å
35	L	63.5	Low	61.3	Low	62 Å²	62	96.7 Å²	96.7	33%	0.325	52%	0.521	S	S	.	.	H	α-helix	trans	-66.4	-38.7	172.9	-68	172.1	0	0	0	111.7	L30 T31 D32 L38 A39	L30-L35 HydrophobicContact CB-CD2 3.95Å; L30-L35 HydrophobicContact CB-CG 3.98Å; L30-L35 HydrophobicContact CD1-CD2 3.92Å; T31-L35 WeakPolarHBondContact O-CG 3.35Å; T31-L35 PolarHBondContact O-N 3.42Å; D32-L35 PolarHBondContact O-N 3.47Å; L35-L38 PolarHBondContact O-N 3.04Å; L35-A39 WeakPolarHBondContact O-CB 3.45Å; L35-A39 PolarHBondContact O-N 2.94Å
36	L	65.7	Low	61.4	Low	104 Å²	104	98.3 Å²	98.3	55%	0.545	52%	0.517	S	S	.	.	H	α-helix	trans	-66.4	-44.1	174.6	-176	62.7	0	0	0	111.5	D32 D33 L38 A39 I40	D32-L36 WeakPolarHBondContact O-CB 3.46Å; D32-L36 PolarHBondContact O-N 3.3Å; D33-L36 PolarHBondContact O-N 3.2Å; L36-L38 PolarHBondContact O-N 3.09Å; L36-A39 PolarHBondContact O-N 2.73Å; L36-I40 HydrophobicContact CD1-CD1 4.48Å; L36-I40 HydrophobicContact CG-CD1 4.14Å; L36-I40 VanDerWaalsContact O-CG1 3.29Å; L36-I40 WeakPolarHBondContact O-CG1 3.35Å; L36-I40 PolarHBondContact O-N 3.01Å
37	Q	67.8	Low	61.2	Low	122 Å²	122	98.2 Å²	98.2	57%	0.57	52%	0.515	S	S	*	.	H	α-helix	trans	-58.1	-47.1	174.3	-164.7	93.3	2.9	0	0	110.9	D33 E34 A39 I40 E41	D33-Q37 WeakPolarHBondContact O-CB 3.45Å; D33-Q37 PolarHBondContact O-N 3.34Å; E34-Q37 PolarHBondContact O-N 2.86Å; Q37-A39 VanDerWaalsContact C-N 3.34Å; Q37-A39 PolarHBondContact O-N 2.76Å; Q37-I40 PolarHBondContact O-N 3.24Å; Q37-E41 PolarHBondContact O-N 2.78Å
38	L	73.6	Confident	60.7	Low	57 Å²	57	102.2 Å²	102.2	30%	0.298	54%	0.536	S	S	.	.	H	α-helix	trans	-64.4	-36	178.5	-166.9	78.2	0	0	0	112.6	Y27 E34 L35 L36 R42	Y27-L38 HydrophobicContact CD1-CD2 3.99Å; Y27-L38 HydrophobicContact CE1-CD2 3.52Å; E34-L38 WeakPolarHBondContact O-CB 3.41Å; E34-L38 PolarHBondContact O-N 2.82Å; L35-L38 PolarHBondContact O-N 3.04Å; L36-L38 PolarHBondContact O-N 3.09Å; L38-R42 WeakPolarHBondContact O-CB 3.27Å; L38-R42 PolarHBondContact O-N 3.16Å
39	A	63.3	Low	60.2	Low	56 Å²	56	103.1 Å²	103.1	46%	0.463	54%	0.542	S	S	.	.	H	α-helix	trans	-68.1	-38.8	174.5	0	0	0	0	0	112	L35 L36 Q37 S43	L35-A39 WeakPolarHBondContact O-CB 3.45Å; L35-A39 PolarHBondContact O-N 2.94Å; L36-A39 PolarHBondContact O-N 2.73Å; Q37-A39 VanDerWaalsContact C-N 3.34Å; Q37-A39 PolarHBondContact O-N 2.76Å; A39-S43 WeakPolarHBondContact O-CB 3.4Å; A39-S43 PolarHBondContact O-N 3.46Å
40	I	68.3	Low	59.3	Low	86 Å²	86	99.4 Å²	99.4	44%	0.441	53%	0.528	S	S	.	.	H	α-helix	trans	-64.5	-46.7	174.3	-68.9	163.2	0	0	0	110.4	L36 Q37 R42 S43 L44	L36-I40 HydrophobicContact CD1-CD1 4.48Å; L36-I40 HydrophobicContact CG-CD1 4.14Å; L36-I40 VanDerWaalsContact O-CG1 3.29Å; L36-I40 WeakPolarHBondContact O-CG1 3.35Å; L36-I40 PolarHBondContact O-N 3.01Å; Q37-I40 PolarHBondContact O-N 3.24Å; I40-R42 PolarHBondContact O-N 3.14Å; I40-S43 PolarHBondContact O-N 3.22Å; I40-L44 HydrophobicContact CG2-CD1 3.9Å; I40-L44 HydrophobicContact CG2-CG 4.48Å; I40-L44 VanDerWaalsContact O-CG 3.31Å; I40-L44 WeakPolarHBondContact O-CG 3.31Å; I40-L44 PolarHBondContact O-N 3.26Å
41	E	68.2	Low	57.8	Low	112 Å²	112	99.2 Å²	99.2	52%	0.523	54%	0.542	S	S	.	.	H	α-helix	trans	-62.2	-42.9	177.4	-73	-176.4	174.1	0	0	112.4	Q37 L44 T45	Q37-E41 PolarHBondContact O-N 2.78Å; E41-L44 PolarHBondContact O-N 3.49Å; E41-T45 WeakPolarHBondContact O-CG2 3.18Å; E41-T45 PolarHBondContact O-N 3.2Å; E41-T45 PolarHBondContact O-OG1 2.9Å
42	R	59.4	Low	56	Low	137 Å²	137	99.6 Å²	99.6	52%	0.517	55%	0.553	S	S	.	*	H	α-helix	trans	-60.1	-47.7	173.3	-87.7	-173.9	159.7	156.3	-2.8	112.2	Y27 L38 I40 L44 T45 E46	Y27-R42 PolarHBondContact OH-NH1 2.89Å; Y27-R42 VanDerWaalsContact OH-NH1 3.09Å; Y27-R42 PolarHBondContact OH-NH2 2.85Å; L38-R42 WeakPolarHBondContact O-CB 3.27Å; L38-R42 PolarHBondContact O-N 3.16Å; I40-R42 PolarHBondContact O-N 3.14Å; R42-L44 VanDerWaalsContact C-N 3.31Å; R42-L44 PolarHBondContact O-N 3.42Å; R42-T45 WeakPolarHBondContact CA-OG1 3.46Å; R42-T45 PolarHBondContact O-N 3.1Å; R42-T45 VanDerWaalsContact O-N 3.12Å; R42-T45 PolarHBondContact O-OG1 3.24Å; R42-E46 PolarHBondContact O-N 3.11Å
43	S	62.3	Low	54.6	Low	65 Å²	65	97.4 Å²	97.4	46%	0.455	55%	0.554	S	S	.	*	H	α-helix	trans	-59.5	-39.7	178	-169.8	0	0	0	0	112.5	A39 I40 E46 M47	A39-S43 WeakPolarHBondContact O-CB 3.4Å; A39-S43 PolarHBondContact O-N 3.46Å; I40-S43 PolarHBondContact O-N 3.22Å; S43-E46 PolarHBondContact O-N 3.34Å; S43-M47 WeakPolarHBondContact O-CG 3.26Å; S43-M47 PolarHBondContact O-N 2.8Å
44	L	54.8	Low	53.1	Low	97 Å²	97	95.4 Å²	95.4	51%	0.508	56%	0.556	S	S	.	*	H	α-helix	trans	-67.1	-37.1	175.3	-70.9	169.5	0	0	0	112.7	I40 E41 R42 Q48	I40-L44 HydrophobicContact CG2-CD1 3.9Å; I40-L44 HydrophobicContact CG2-CG 4.48Å; I40-L44 VanDerWaalsContact O-CG 3.31Å; I40-L44 WeakPolarHBondContact O-CG 3.31Å; I40-L44 PolarHBondContact O-N 3.26Å; E41-L44 PolarHBondContact O-N 3.49Å; R42-L44 VanDerWaalsContact C-N 3.31Å; R42-L44 PolarHBondContact O-N 3.42Å; L44-Q48 PolarHBondContact O-N 3.03Å
45	T	55.2	Low	51.5	Low	79 Å²	79	97.3 Å²	97.3	49%	0.485	57%	0.574	S	S	.	*	H	α-helix	trans	-72.1	-33	174.9	54.8	0	0	0	0	113.4	E41 R42 Q48 C49	E41-T45 WeakPolarHBondContact O-CG2 3.18Å; E41-T45 PolarHBondContact O-N 3.2Å; E41-T45 PolarHBondContact O-OG1 2.9Å; R42-T45 WeakPolarHBondContact CA-OG1 3.46Å; R42-T45 PolarHBondContact O-N 3.1Å; R42-T45 VanDerWaalsContact O-N 3.12Å; R42-T45 PolarHBondContact O-OG1 3.24Å; T45-Q48 PolarHBondContact O-N 2.92Å; T45-C49 PolarHBondContact O-N 3.34Å
46	E	46.3	Very low	49.9	Very low	135 Å²	135	103.1 Å²	103.1	63%	0.631	60%	0.599	S	S	*	*	H	α-helix	trans	-69.8	-34.8	173.7	-72.6	-178.2	173	0	0	112.3	R42 S43 Q48 C49 S50	R42-E46 PolarHBondContact O-N 3.11Å; S43-E46 PolarHBondContact O-N 3.34Å; E46-Q48 VanDerWaalsContact C-N 3.27Å; E46-Q48 PolarHBondContact O-N 3.33Å; E46-C49 PolarHBondContact O-N 2.96Å; E46-S50 PolarHBondContact O-N 3.45Å; E46-S50 VanDerWaalsContact O-N 3.09Å; E46-S50 PolarHBondContact O-OG 2.95Å
47	M	44.3	Very low	48.1	Very low	130 Å²	130	105.4 Å²	105.4	64%	0.64	62%	0.618	S	S	*	*	H	α-helix	trans	-62.5	-31.6	170.1	-77.3	-176.5	65.1	0	0	113	S43 S50	S43-M47 WeakPolarHBondContact O-CG 3.26Å; S43-M47 PolarHBondContact O-N 2.8Å; M47-S50 WeakPolarHBondContact CA-OG 3.3Å; M47-S50 PolarHBondContact O-OG 3.35Å
48	Q	44	Very low	46	Very low	156 Å²	156	104.1 Å²	104.1	73%	0.729	63%	0.628	S	S	*	*	H	α-helix	trans	-77.1	-30	176.7	-69.8	-179.8	4.4	0	0	113	L44 T45 E46	L44-Q48 PolarHBondContact O-N 3.03Å; T45-Q48 PolarHBondContact O-N 2.92Å; E46-Q48 VanDerWaalsContact C-N 3.27Å; E46-Q48 PolarHBondContact O-N 3.33Å
49	C	38.6	Very low	43.6	Very low	102 Å²	102	113.1 Å²	113.1	69%	0.689	66%	0.658	S	S	*	*	H	α-helix	trans	-76.2	-31.1	173.9	-71.9	0	0	0	0	113.3	T45 E46 G51 A52	T45-C49 PolarHBondContact O-N 3.34Å; E46-C49 PolarHBondContact O-N 2.96Å; C49-G51 VanDerWaalsContact C-N 3.35Å; C49-G51 PolarHBondContact O-N 3.01Å; C49-A52 PolarHBondContact O-N 3.41Å
50	S	37	Very low	41.8	Very low	80 Å²	80	118.3 Å²	118.3	56%	0.559	68%	0.677	S	S	*	*	H	α-helix	trans	-76.5	-17.6	-179	43	0	0	0	0	114.1	E46 M47 A52	E46-S50 PolarHBondContact O-N 3.45Å; E46-S50 VanDerWaalsContact O-N 3.09Å; E46-S50 PolarHBondContact O-OG 2.95Å; M47-S50 WeakPolarHBondContact CA-OG 3.3Å; M47-S50 PolarHBondContact O-OG 3.35Å; S50-A52 VanDerWaalsContact C-N 3.32Å; S50-A52 PolarHBondContact O-N 3.42Å
51	G	36.4	Very low	39.7	Very low	63 Å²	63	123.1 Å²	123.1	65%	0.649	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	-16.9	172.4	0	0	0	0	0	115.5	C49	C49-G51 VanDerWaalsContact C-N 3.35Å; C49-G51 PolarHBondContact O-N 3.01Å
52	A	33.7	Very low	37.6	Very low	89 Å²	89	125.8 Å²	125.8	74%	0.736	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-8.7	-174.3	0	0	0	0	0	114.8	C49 S50	C49-A52 PolarHBondContact O-N 3.41Å; S50-A52 VanDerWaalsContact C-N 3.32Å; S50-A52 PolarHBondContact O-N 3.42Å
53	A	32.3	Very low	35.9	Very low	92 Å²	92	127.1 Å²	127.1	76%	0.76	73%	0.733	S	S	*	*	S	Bend	trans	-100.7	9.8	-173.1	0	0	0	0	0	114.6
54	A	32.3	Very low	34.2	Very low	86 Å²	86	128.6 Å²	128.6	71%	0.711	75%	0.749	S	S	*	*			trans	-114	26.4	-168.9	0	0	0	0	0	115.4
55	V	33.6	Very low	33.1	Very low	134 Å²	134	130 Å²	130	81%	0.812	76%	0.764	S	S	*	*	S	Bend	trans	-139.1	77.3	168.9	-170.7	0	0	0	0	111.3
56	Q	31.5	Very low	31.6	Very low	184 Å²	184	134.8 Å²	134.8	86%	0.86	78%	0.781	S	S	*	*	S	Bend	trans	166.8	79.3	146	-93.5	167.7	21.7	0	0	111.7
57	T	27.7	Very low	31.1	Very low	152 Å²	152	133.2 Å²	133.2	93%	0.933	78%	0.782	S	S	*	*			trans	-172.4	77.1	148.4	23.9	0	0	0	0	109.3
58	A	23.9	Very low	30.1	Very low	95 Å²	95	132.9 Å²	132.9	79%	0.785	79%	0.787	S	S	*	*			trans	-147.2	87.9	172.5	0	0	0	0	0	110.6
59	R	23.2	Very low	29.3	Very low	245 Å²	245	129.8 Å²	129.8	93%	0.925	78%	0.783	S	S	*	*			trans	172.6	103.9	151.4	-98.4	164	-166.6	-157.8	3.6	109.5
60	L	24.6	Very low	28.7	Very low	166 Å²	166	131.6 Å²	131.6	87%	0.869	79%	0.791	S	S	*	*				-178.5	150.5	119.3	-96.7	167.3	0	0	0	109.9
61	Q	24.3	Very low	28.1	Very low	186 Å²	186	132 Å²	132	87%	0.869	79%	0.794	S	S	*	*			trans	71.2	101.3	176.9	-57	178.8	5.2	0	0	115.9
62	D	24.5	Very low	27.6	Very low	169 Å²	169	139 Å²	139	90%	0.904	80%	0.801	S	S	*	*			trans	-140.5	141.9	133	-124.7	-27.5	0	0	0	109.8
63	N	24	Very low	27.2	Very low	164 Å²	164	143.8 Å²	143.8	88%	0.877	80%	0.801	S	S	*	*			trans	-95.9	134.5	-178.4	-77.7	-48.7	0	0	0	110.3
64	A	26.5	Very low	26.9	Very low	96 Å²	96	145.9 Å²	145.9	79%	0.793	80%	0.795	S	S	*	*			trans	-151.1	156.1	168.5	0	0	0	0	0	110
65	P	31.8	Very low	26.5	Very low	126 Å²	126	151.6 Å²	151.6	82%	0.818	80%	0.799	S	S	*	*			trans	-104.3	165.7	-139.5	18.2	-1.5	0	0	0	116
66	E	24	Very low	26	Very low	180 Å²	180	156.8 Å²	156.8	84%	0.841	80%	0.803	S	S	*	*			trans	-66.3	156.3	165.9	-125	-172.4	-124.2	0	0	111.4
67	P	34.9	Very low	25.7	Very low	102 Å²	102	152.3 Å²	152.3	66%	0.662	80%	0.798	S	S	*	*				-152.4	172	79	42.3	-24.6	0	0	0	117.6
68	T	24	Very low	26.3	Very low	123 Å²	123	150.6 Å²	150.6	76%	0.755	79%	0.789	S	S	*	*			trans	64.1	130.2	158.7	53.1	0	0	0	0	117.7
69	S	25.7	Very low	26.4	Very low	92 Å²	92	151.2 Å²	151.2	64%	0.643	79%	0.788	S	S	*	*			cis	175.6	156.3	15.5	48.8	0	0	0	0	109
70	T	25.8	Very low	26.5	Very low	140 Å²	140	144.1 Å²	144.1	86%	0.859	78%	0.776	S	S	*	*			trans	66.4	150.2	165.8	69.4	0	0	0	0	118
71	S	25.8	Very low	26.8	Very low	88 Å²	88	144.6 Å²	144.6	62%	0.615	77%	0.774	S	S	*	*			cis	-173	132	-22	158.3	0	0	0	0	110.1
72	R	25.9	Very low	26.8	Very low	211 Å²	211	142.9 Å²	142.9	80%	0.796	77%	0.77	S	S	*	*			trans	73.5	132.2	150.8	-75	173.6	-171.4	178.7	4.1	121.9
73	Y	24.8	Very low	27.6	Very low	189 Å²	189	140.4 Å²	140.4	74%	0.741	76%	0.763	S	S	*	*			trans	55.3	123.1	137.9	-63	-48.9	0	0	0	119.1
74	Q	25.3	Very low	28.4	Very low	135 Å²	135	137.9 Å²	137.9	63%	0.631	76%	0.756	S	S	*	*			cis	120.9	141.2	38.6	-123	-167.9	38.6	0	0	108.3
75	R	24.8	Very low	28.4	Very low	207 Å²	207	138.2 Å²	138.2	78%	0.781	76%	0.759	S	S	*	*			trans	85.8	117.3	156.3	-65.6	173.5	-166.1	-151.9	1.1	121
76	R	23.5	Very low	28.1	Very low	242 Å²	242	136 Å²	136	91%	0.913	75%	0.751	S	S	*	*				57.5	117.3	124.5	-70	-173.8	171.6	-173.7	-3.4	120.1
77	A	25.3	Very low	28.2	Very low	91 Å²	91	136.1 Å²	136.1	75%	0.752	75%	0.752	S	S	*	*			trans	-68.6	178.8	145.5	0	0	0	0	0	111.1
78	P	39.7	Very low	27.8	Very low	115 Å²	115	138 Å²	138	75%	0.747	76%	0.762	S	S	*	*			cis	-140.4	-173	6.6	41.4	-21.8	0	0	0	116.1
79	S	25.2	Very low	27.8	Very low	108 Å²	108	137.5 Å²	137.5	76%	0.755	76%	0.763	S	S	*	*			trans	124.6	129.1	136	74.3	0	0	0	0	119.8
80	S	26.4	Very low	27.7	Very low	97 Å²	97	137.6 Å²	137.6	68%	0.678	77%	0.769	S	S	*	*			trans	107	130.7	133.7	80	0	0	0	0	121.9
81	H	29.8	Very low	27.6	Very low	176 Å²	176	137 Å²	137	82%	0.815	77%	0.766	S	S	*	*			trans	75.9	93.2	152.9	-59	-49.4	0	0	0	123.8
82	N	25.9	Very low	27.5	Very low	150 Å²	150	143.8 Å²	143.8	80%	0.802	78%	0.78	S	S	*	*				-6.7	169.3	128	-66.9	-0	0	0	0	120
83	P	41.6	Very low	27.4	Very low	116 Å²	116	138.8 Å²	138.8	75%	0.753	78%	0.777	S	S	*	*			cis	-132.7	-135.5	-31.8	39.2	-18.1	0	0	0	109.2
84	P	40.1	Very low	27.5	Very low	111 Å²	111	134.5 Å²	134.5	72%	0.721	77%	0.774	S	S	*	*			cis	-131.5	177	-29.7	39.6	-23	0	0	0	116
85	A	26.1	Very low	27.6	Very low	103 Å²	103	133.9 Å²	133.9	85%	0.851	78%	0.782	S	S	*	*			trans	67.4	149.4	156.9	0	0	0	0	0	119.2
86	A	26	Very low	27.8	Very low	80 Å²	80	130.6 Å²	130.6	66%	0.661	78%	0.78	S	S	*	*			cis	-151.9	158.2	4.6	0	0	0	0	0	112.3
87	Q	25.3	Very low	28.2	Very low	182 Å²	182	124.2 Å²	124.2	85%	0.85	77%	0.77	S	S	*	*			trans	48.4	130.1	149.2	-63.1	167.6	11.7	0	0	118.9
88	T	26.8	Very low	28.4	Very low	142 Å²	142	123.8 Å²	123.8	87%	0.871	76%	0.76	S	S	*	*				-142.6	155.2	52.1	42.9	0	0	0	0	114.8
89	S	24.4	Very low	28.3	Very low	112 Å²	112	125.8 Å²	125.8	78%	0.783	77%	0.77	S	S	*	*			trans	-97.6	139.7	178.9	51.8	0	0	0	0	112.6
90	A	23.9	Very low	29.4	Very low	94 Å²	94	126.8 Å²	126.8	78%	0.777	76%	0.762	S	S	*	*			trans	-146.9	70.5	159.2	0	0	0	0	0	111.1	Y92	A90-Y92 PolarHBondContact O-N 3.05Å
91	T	22.9	Very low	30.6	Very low	128 Å²	128	131.4 Å²	131.4	79%	0.785	77%	0.77	S	S	*	*			trans	-70	117.4	161.7	40	0	0	0	0	109.7
92	Y	23.5	Very low	31.9	Very low	231 Å²	231	126.7 Å²	126.7	91%	0.906	76%	0.756	S	S	*	*			trans	-105.4	110.7	156.6	-95.2	-81.6	0	0	0	109.3	A90	A90-Y92 PolarHBondContact O-N 3.05Å
93	S	23.8	Very low	33.6	Very low	105 Å²	105	121.3 Å²	121.3	73%	0.734	73%	0.729	S	S	*	*			trans	-90.8	120.5	176.3	-69.1	0	0	0	0	111
94	S	27.7	Very low	34.4	Very low	99 Å²	99	120.3 Å²	120.3	69%	0.692	72%	0.717	S	S	*	*			trans	68.9	157.7	146.8	-109.5	0	0	0	0	117.4	N96	S94-N96 PolarHBondContact OG-N 3.49Å
95	P	27	Very low	35.2	Very low	122 Å²	122	120.3 Å²	120.3	79%	0.792	71%	0.71	S	S	*	*			cis	-112.6	142.1	43.8	11.4	10.2	0	0	0	115.4
96	N	28	Very low	36.6	Very low	139 Å²	139	124.5 Å²	124.5	74%	0.743	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-56.1	131.5	144.5	-76.4	-23.3	0	0	0	108.6	S94	S94-N96 PolarHBondContact OG-N 3.49Å
97	P	31.8	Very low	38	Very low	107 Å²	107	126 Å²	126	70%	0.695	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-57.6	152.6	155.2	-16	30.7	0	0	0	109.2
98	P	30.4	Very low	40.2	Very low	83 Å²	83	119.6 Å²	119.6	54%	0.539	68%	0.68	S	S	.	*	P	Polyproline II helix	trans	-61.2	155.8	-172.7	26.6	-35.7	0	0	0	112.1	E100	P98-E100 HydrophobicContact CB-CG 4.13Å; P98-E100 HydrophobicContact CG-CG 3.85Å; P98-E100 PolarHBondContact O-N 2.87Å
99	T	38.4	Very low	41.8	Very low	156 Å²	156	119.1 Å²	119.1	96%	0.957	67%	0.672	S	S	*	*			trans	-69.6	65.4	163.1	42.8	0	0	0	0	110.7
100	E	47.1	Very low	44.3	Very low	129 Å²	129	114.9 Å²	114.9	60%	0.603	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-84.5	139.3	164.5	-75.4	177.3	-170.7	0	0	108.8	P98	P98-E100 HydrophobicContact CB-CG 4.13Å; P98-E100 HydrophobicContact CG-CG 3.85Å; P98-E100 PolarHBondContact O-N 2.87Å
101	K	52.3	Low	46.7	Very low	194 Å²	194	114.6 Å²	114.6	84%	0.843	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-65.8	140.3	172.4	-71.4	176	176.5	177.4	0	108.1
102	P	57.7	Low	49.5	Very low	78 Å²	78	110.8 Å²	110.8	51%	0.506	61%	0.611	S	S	.	*	P	Polyproline II helix	trans	-56	138.1	176.1	24.5	-33.9	0	0	0	109.5	D104	P102-D104 PolarHBondContact O-N 3.04Å
103	P	60.6	Low	52	Low	37 Å²	37	102.3 Å²	102.3	24%	0.24	59%	0.586	C	S	.	*	P	Polyproline II helix	trans	-61.9	137.6	-178.9	25.7	-33.9	0	0	0	110.1	L105 F108 Y126	P103-L105 PolarHBondContact O-N 3.39Å; P103-L105 VanDerWaalsContact O-N 3.13Å; P103-F108 HydrophobicContact CB-CB 4.31Å; P103-F108 HydrophobicContact CB-CD2 3.77Å; P103-F108 HydrophobicContact CB-CG 4.31Å; P103-F108 HydrophobicContact CG-CD2 3.79Å; P103-F108 HydrophobicContact CG-CE2 4.21Å; P103-F108 HydrophobicContact CG-CG 4.26Å; P103-Y126 HydrophobicContact CG-CD1 3.85Å; P103-Y126 HydrophobicContact CG-CE1 4.14Å; P103-Y126 HydrophobicContact CG-CG 4.12Å
104	D	58	Low	54.8	Low	95 Å²	95	105.2 Å²	105.2	51%	0.508	58%	0.581	S	S	.	*	P	Polyproline II helix	trans	-61.2	120.3	-180	-177.1	-11.8	0	0	0	109.6	P102 K106 T107 F108	P102-D104 PolarHBondContact O-N 3.04Å; D104-K106 PolarHBondContact O-N 2.88Å; D104-K106 PolarHBondContact OD1-N 3.22Å; D104-T107 PolarHBondContact O-N 2.99Å; D104-T107 PolarHBondContact O-OG1 3.39Å; D104-F108 PolarHBondContact O-N 2.94Å
105	L	57.5	Low	57	Low	111 Å²	111	104.3 Å²	104.3	58%	0.581	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.3	-19.6	-179.2	-78.3	157.1	0	0	0	113.3	P103 Y126	P103-L105 PolarHBondContact O-N 3.39Å; P103-L105 VanDerWaalsContact O-N 3.13Å; L105-Y126 HydrophobicContact CD2-CE1 3.8Å; L105-Y126 HydrophobicContact CG-CE1 4.34Å
106	K	55.2	Low	59.2	Low	191 Å²	191	105 Å²	105	83%	0.83	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-16.9	175	-64.5	-177.9	-178.5	175.6	0	114.3	D104	D104-K106 PolarHBondContact O-N 2.88Å; D104-K106 PolarHBondContact OD1-N 3.22Å
107	T	56.4	Low	61.6	Low	111 Å²	111	100.5 Å²	100.5	68%	0.681	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.7	-10.2	-174.9	55.9	0	0	0	0	114.1	D104 N109	D104-T107 PolarHBondContact O-N 2.99Å; D104-T107 PolarHBondContact O-OG1 3.39Å; T107-N109 PolarHBondContact O-N 2.96Å
108	F	70.7	Confident	62.8	Low	48 Å²	48	100.1 Å²	100.1	21%	0.211	55%	0.551	C	S	.	*			trans	-74	116.8	179.6	-174.1	-106	0	0	0	112	P103 D104 G110 V112 Y126 Y127 V134	P103-F108 HydrophobicContact CB-CB 4.31Å; P103-F108 HydrophobicContact CB-CD2 3.77Å; P103-F108 HydrophobicContact CB-CG 4.31Å; P103-F108 HydrophobicContact CG-CD2 3.79Å; P103-F108 HydrophobicContact CG-CE2 4.21Å; P103-F108 HydrophobicContact CG-CG 4.26Å; D104-F108 PolarHBondContact O-N 2.94Å; F108-G110 VanDerWaalsContact CE1-CA 3.49Å; F108-G110 PolarHBondContact O-N 3.39Å; F108-V112 HydrophobicContact CD1-CG2 4.32Å; F108-V112 HydrophobicContact CE1-CG2 4.48Å; F108-Y126 AromaticContact CD1-CD1 3.96Å; F108-Y126 HydrophobicContact CD1-CD1 3.96Å; F108-Y126 HydrophobicContact CE1-CD1 4.04Å; F108-Y126 HydrophobicContact CG-CD1 4.36Å; F108-Y127 WeakPolarHBondContact CE1-O 3.32Å; F108-Y127 WeakPolarHBondContact CZ-O 3.39Å; F108-V134 HydrophobicContact CE2-CB 4.48Å; F108-V134 HydrophobicContact CE2-CG1 4.35Å; F108-V134 HydrophobicContact CE2-CG2 4.16Å; F108-V134 HydrophobicContact CZ-CB 4.43Å; F108-V134 HydrophobicContact CZ-CG2 3.97Å
109	N	60.3	Low	64.6	Low	132 Å²	132	100.6 Å²	100.6	71%	0.706	56%	0.557	S	S	*	*			trans	-96.3	85.9	176.6	-168.7	-0.7	0	0	0	109.8	T107 N129	T107-N109 PolarHBondContact O-N 2.96Å; N109-N129 PolarHBondContact OD1-ND2 3.35Å
110	G	76.8	Confident	65.5	Low	23 Å²	23	95.8 Å²	95.8	24%	0.237	54%	0.538	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.7	177	-173.4	0	0	0	0	0	113.4	F108 Y127 N129	F108-G110 VanDerWaalsContact CE1-CA 3.49Å; F108-G110 PolarHBondContact O-N 3.39Å; G110-Y127 CarbonylContact C-O 3.43Å; G110-Y127 WeakPolarHBondContact CA-O 3.41Å; G110-N129 WeakPolarHBondContact CA-OD1 3.04Å
111	T	75.1	Confident	66.6	Low	87 Å²	87	96.3 Å²	96.3	53%	0.534	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	139.9	-179.9	-54.9	0	0	0	0	110.8	Y127	T111-Y127 PolarHBondContact N-O 3.03Å; T111-Y127 PolarHBondContact O-N 3.39Å
112	V	80.7	Confident	67.6	Low	49 Å²	49	93.5 Å²	93.5	30%	0.297	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	120.8	179.9	-176.5	0	0	0	0	110.3	F108 V124 A125 Y126	F108-V112 HydrophobicContact CD1-CG2 4.32Å; F108-V112 HydrophobicContact CE1-CG2 4.48Å; V112-V124 HydrophobicContact CG1-CG1 3.36Å; V112-A125 CarbonylContact C-O 3.52Å; V112-A125 WeakPolarHBondContact CA-O 3.46Å; V112-Y126 HydrophobicContact CG1-CE1 4.46Å; V112-Y126 HydrophobicContact CG2-CD1 3.84Å; V112-Y126 HydrophobicContact CG2-CE1 4.14Å
113	S	76.3	Confident	68.5	Low	53 Å²	53	91.2 Å²	91.2	37%	0.371	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	149	177.9	-167.8	0	0	0	0	111.6	V124 A125	S113-V124 WeakPolarHBondContact O-CA 3.4Å; S113-A125 PolarHBondContact N-O 3.02Å; S113-A125 PolarHBondContact O-N 3.39Å
114	R	83.3	Confident	69.5	Low	166 Å²	166	89.8 Å²	89.8	63%	0.626	50%	0.496	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120	134.5	177.6	-66.8	-178.2	173.3	78.9	0.4	109.8	M123 V124 E139	R114-M123 WeakPolarHBondContact CA-O 3.33Å; R114-V124 HydrophobicContact CG-CG2 4.38Å; R114-E139 VanDerWaalsContact CD-OE1 3.26Å; R114-E139 WeakPolarHBondContact CD-OE1 3.45Å; R114-E139 IonicContact CZ-OE1 2.76Å; R114-E139 IonicContact NE-OE1 2.61Å; R114-E139 PolarHBondContact NE-OE1 3.4Å
115	F	74.5	Confident	70.6	Confident	80 Å²	80	85.2 Å²	85.2	35%	0.351	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	169.2	179.9	67.1	-78.6	0	0	0	111.2	M123 A125 I136	F115-M123 HydrophobicContact CD1-CB 4.02Å; F115-M123 HydrophobicContact CD2-CB 4.16Å; F115-M123 HydrophobicContact CE1-CB 3.56Å; F115-M123 HydrophobicContact CE2-CB 3.73Å; F115-M123 HydrophobicContact CE2-CG 3.99Å; F115-M123 HydrophobicContact CG-CB 4.3Å; F115-M123 HydrophobicContact CZ-CB 3.41Å; F115-M123 VanDerWaalsContact CZ-CB 3.41Å; F115-M123 HydrophobicContact CZ-CG 4.04Å; F115-M123 PolarHBondContact N-O 3.33Å; F115-M123 PolarHBondContact O-N 2.92Å; F115-A125 HydrophobicContact CD1-CB 4.43Å; F115-A125 HydrophobicContact CE1-CB 3.91Å; F115-I136 HydrophobicContact CE1-CG2 4.21Å; F115-I136 HydrophobicContact CZ-CD1 4.21Å; F115-I136 HydrophobicContact CZ-CG2 3.82Å
116	M	73.3	Confident	71.7	Confident	137 Å²	137	80.4 Å²	80.4	68%	0.675	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.8	142.5	174.6	-68.1	-170.5	-65.5	0	0	110.8	K121 R122	M116-K121 WeakPolarHBondContact CA-O 3.46Å; M116-R122 HydrophobicContact CG-CG 4.06Å; M116-R122 HydrophobicContact SD-CG 4.35Å
117	T	77.1	Confident	72.8	Confident	44 Å²	44	74.9 Å²	74.9	27%	0.27	42%	0.42	S	S	.	.			trans	-73.5	161.4	167.6	64.5	0	0	0	0	110.7	S119 G120 K121 M123	T117-S119 PolarHBondContact O-N 3.42Å; T117-S119 PolarHBondContact OG1-N 3.23Å; T117-S119 PolarHBondContact OG1-OG 3.45Å; T117-G120 PolarHBondContact O-N 3.07Å; T117-K121 HydrophobicContact CG2-CB 4.48Å; T117-K121 PolarHBondContact N-O 3.19Å; T117-K121 PolarHBondContact OG1-N 3.1Å; T117-K121 VanDerWaalsContact OG1-N 3.15Å; T117-K121 PolarHBondContact OG1-O 3.01Å; T117-M123 HydrophobicContact CG2-CG 3.57Å; T117-M123 HydrophobicContact CG2-SD 4.08Å
118	G	57.9	Low	73.8	Confident	98 Å²	98	74.7 Å²	74.7	100%	1.01	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-7.8	168.8	0	0	0	0	0	114.7
119	S	67.3	Low	74.1	Confident	94 Å²	94	77.9 Å²	77.9	66%	0.657	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	10.9	171.3	53.3	0	0	0	0	113.8	T117 K121	T117-S119 PolarHBondContact O-N 3.42Å; T117-S119 PolarHBondContact OG1-N 3.23Å; T117-S119 PolarHBondContact OG1-OG 3.45Å; S119-K121 VanDerWaalsContact C-N 3.28Å; S119-K121 PolarHBondContact O-N 2.82Å
120	G	56.7	Low	74.8	Confident	55 Å²	55	77.2 Å²	77.2	57%	0.567	43%	0.426	S	S	*	.	S	Bend	trans	75.5	6.7	176.7	0	0	0	0	0	115.3	T117	T117-G120 PolarHBondContact O-N 3.07Å
121	K	70.5	Confident	74.6	Confident	140 Å²	140	78.6 Å²	78.6	61%	0.609	44%	0.44	S	S	*	.			trans	-80.8	129.5	176.7	-64.8	-170.7	174.8	-172.2	0	109.9	M116 T117 S119	M116-K121 WeakPolarHBondContact CA-O 3.46Å; T117-K121 HydrophobicContact CG2-CB 4.48Å; T117-K121 PolarHBondContact N-O 3.19Å; T117-K121 PolarHBondContact OG1-N 3.1Å; T117-K121 VanDerWaalsContact OG1-N 3.15Å; T117-K121 PolarHBondContact OG1-O 3.01Å; S119-K121 VanDerWaalsContact C-N 3.28Å; S119-K121 PolarHBondContact O-N 2.82Å
122	R	73	Confident	74.7	Confident	135 Å²	135	76.8 Å²	76.8	51%	0.509	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	135.4	171.8	-60.6	-166.5	-56	-84.4	-4.1	109.6	M116 E139	M116-R122 HydrophobicContact CG-CG 4.06Å; M116-R122 HydrophobicContact SD-CG 4.35Å; R122-E139 HydrophobicContact CB-CB 3.89Å; R122-E139 WeakPolarHBondContact CD-OE2 3.47Å; R122-E139 IonicContact CZ-OE2 2.9Å; R122-E139 IonicContact NE-OE2 3.34Å; R122-E139 PolarHBondContact NE-OE2 3.3Å; R122-E139 IonicContact NH2-OE2 2.73Å; R122-E139 PolarHBondContact O-N 3.25Å
123	M	77.8	Confident	74.5	Confident	30 Å²	30	78.7 Å²	78.7	15%	0.148	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	148.7	-177	-56.3	-65.9	-65.9	0	0	109.6	R114 F115 T117 I136 A137 P138	R114-M123 WeakPolarHBondContact CA-O 3.33Å; F115-M123 HydrophobicContact CD1-CB 4.02Å; F115-M123 HydrophobicContact CD2-CB 4.16Å; F115-M123 HydrophobicContact CE1-CB 3.56Å; F115-M123 HydrophobicContact CE2-CB 3.73Å; F115-M123 HydrophobicContact CE2-CG 3.99Å; F115-M123 HydrophobicContact CG-CB 4.3Å; F115-M123 HydrophobicContact CZ-CB 3.41Å; F115-M123 VanDerWaalsContact CZ-CB 3.41Å; F115-M123 HydrophobicContact CZ-CG 4.04Å; F115-M123 PolarHBondContact N-O 3.33Å; F115-M123 PolarHBondContact O-N 2.92Å; T117-M123 HydrophobicContact CG2-CG 3.57Å; T117-M123 HydrophobicContact CG2-SD 4.08Å; M123-I136 HydrophobicContact CE-CG2 3.64Å; M123-A137 CarbonylContact C-O 3.13Å; M123-A137 VanDerWaalsContact CA-O 3.26Å; M123-A137 WeakPolarHBondContact CA-O 3.31Å; M123-A137 WeakPolarHBondContact CE-O 3.35Å; M123-P138 HydrophobicContact CE-CG 4.46Å; M123-P138 HydrophobicContact SD-CB 4.31Å; M123-P138 HydrophobicContact SD-CG 4.37Å
124	V	82.1	Confident	74.7	Confident	6 Å²	6	79 Å²	79	4%	0.036	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	124.2	177.1	-177.2	0	0	0	0	108.7	V112 S113 R114 Y126 I136 A137 E139	V112-V124 HydrophobicContact CG1-CG1 3.36Å; S113-V124 WeakPolarHBondContact O-CA 3.4Å; R114-V124 HydrophobicContact CG-CG2 4.38Å; V124-Y126 HydrophobicContact CB-CE2 4.33Å; V124-Y126 HydrophobicContact CG1-CD2 4.31Å; V124-Y126 HydrophobicContact CG1-CE2 3.76Å; V124-I136 WeakPolarHBondContact O-CA 3.42Å; V124-A137 PolarHBondContact N-O 3.25Å; V124-A137 PolarHBondContact O-N 2.94Å; V124-E139 HydrophobicContact CG2-CB 3.68Å; V124-E139 HydrophobicContact CG2-CG 3.72Å
125	A	81.1	Confident	74.4	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	129.1	173.7	0	0	0	0	0	110.5	V112 S113 F115 Y127 L133 H135 I136	V112-A125 CarbonylContact C-O 3.52Å; V112-A125 WeakPolarHBondContact CA-O 3.46Å; S113-A125 PolarHBondContact N-O 3.02Å; S113-A125 PolarHBondContact O-N 3.39Å; F115-A125 HydrophobicContact CD1-CB 4.43Å; F115-A125 HydrophobicContact CE1-CB 3.91Å; A125-Y127 HydrophobicContact CB-CD2 4.33Å; A125-Y127 HydrophobicContact CB-CE2 3.45Å; A125-Y127 VanDerWaalsContact CB-CE2 3.45Å; A125-L133 HydrophobicContact CB-CD1 3.82Å; A125-H135 CarbonylContact C-O 3.42Å; A125-H135 WeakPolarHBondContact CA-O 3.45Å; A125-I136 HydrophobicContact CB-CD1 4.42Å; A125-I136 HydrophobicContact CB-CG1 3.97Å
126	Y	79.4	Confident	74.5	Confident	10 Å²	10	72.6 Å²	72.6	4%	0.039	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	129.7	175.5	-62.5	-99	0	0	0	108.8	P103 L105 F108 V112 V124 V134 H135	P103-Y126 HydrophobicContact CG-CD1 3.85Å; P103-Y126 HydrophobicContact CG-CE1 4.14Å; P103-Y126 HydrophobicContact CG-CG 4.12Å; L105-Y126 HydrophobicContact CD2-CE1 3.8Å; L105-Y126 HydrophobicContact CG-CE1 4.34Å; F108-Y126 AromaticContact CD1-CD1 3.96Å; F108-Y126 HydrophobicContact CD1-CD1 3.96Å; F108-Y126 HydrophobicContact CE1-CD1 4.04Å; F108-Y126 HydrophobicContact CG-CD1 4.36Å; V112-Y126 HydrophobicContact CG1-CE1 4.46Å; V112-Y126 HydrophobicContact CG2-CD1 3.84Å; V112-Y126 HydrophobicContact CG2-CE1 4.14Å; V124-Y126 HydrophobicContact CB-CE2 4.33Å; V124-Y126 HydrophobicContact CG1-CD2 4.31Å; V124-Y126 HydrophobicContact CG1-CE2 3.76Å; Y126-V134 WeakPolarHBondContact O-CB 3.48Å; Y126-V134 PolarHBondContact O-N 3.42Å; Y126-H135 HydrophobicContact CD2-CB 4.07Å; Y126-H135 PolarHBondContact N-O 3.03Å; Y126-H135 PolarHBondContact O-N 3.25Å
127	Y	79	Confident	74.6	Confident	74 Å²	74	66.7 Å²	66.7	29%	0.29	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	144.7	179.3	-58.9	-97.2	0	0	0	110.2	F108 G110 T111 A125 S132 L133	F108-Y127 WeakPolarHBondContact CE1-O 3.32Å; F108-Y127 WeakPolarHBondContact CZ-O 3.39Å; G110-Y127 CarbonylContact C-O 3.43Å; G110-Y127 WeakPolarHBondContact CA-O 3.41Å; T111-Y127 PolarHBondContact N-O 3.03Å; T111-Y127 PolarHBondContact O-N 3.39Å; A125-Y127 HydrophobicContact CB-CD2 4.33Å; A125-Y127 HydrophobicContact CB-CE2 3.45Å; A125-Y127 VanDerWaalsContact CB-CE2 3.45Å; Y127-S132 CarbonylContact C-O 3.46Å; Y127-S132 VanDerWaalsContact CA-O 3.23Å; Y127-S132 WeakPolarHBondContact CA-O 3.46Å; Y127-L133 HydrophobicContact CD1-CB 4.13Å; Y127-L133 HydrophobicContact CD1-CD1 4.06Å; Y127-L133 HydrophobicContact CE1-CB 4.05Å; Y127-L133 HydrophobicContact CE1-CD1 3.66Å; Y127-L133 HydrophobicContact CE1-CG 4.46Å; Y127-L133 HydrophobicContact CE2-CD1 4.24Å
128	K	77.4	Confident	74.3	Confident	108 Å²	108	68.8 Å²	68.8	47%	0.47	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	168.1	167	-68.7	179.8	-166.2	164.8	0	110.4	D130 G131 S132 V134	K128-D130 VanDerWaalsContact CB-OD1 3.27Å; K128-D130 WeakPolarHBondContact CB-OD1 3.42Å; K128-D130 PolarHBondContact O-N 2.86Å; K128-D130 VanDerWaalsContact O-N 3.14Å; K128-G131 PolarHBondContact O-N 3.32Å; K128-S132 PolarHBondContact N-O 3.13Å; K128-V134 HydrophobicContact CB-CG2 4.49Å; K128-V134 HydrophobicContact CD-CG2 4.39Å; K128-V134 HydrophobicContact CG-CG2 3.55Å
129	N	75.9	Confident	74.6	Confident	115 Å²	115	66.2 Å²	66.2	62%	0.615	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-14.7	175.7	-65.7	-20.9	0	0	0	113.9	N109 G110 G131	N109-N129 PolarHBondContact OD1-ND2 3.35Å; G110-N129 WeakPolarHBondContact CA-OD1 3.04Å; N129-G131 VanDerWaalsContact C-N 3.33Å
130	D	76.1	Confident	74.1	Confident	117 Å²	117	66.2 Å²	66.2	63%	0.626	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	0.8	172.3	60.3	25.3	0	0	0	113.7	K128 S132	K128-D130 VanDerWaalsContact CB-OD1 3.27Å; K128-D130 WeakPolarHBondContact CB-OD1 3.42Å; K128-D130 PolarHBondContact O-N 2.86Å; K128-D130 VanDerWaalsContact O-N 3.14Å; D130-S132 VanDerWaalsContact C-N 3.32Å; D130-S132 WeakPolarHBondContact OD1-CB 3.37Å; D130-S132 PolarHBondContact OD1-N 2.97Å; D130-S132 PolarHBondContact OD1-OG 3.29Å
131	G	71.3	Confident	74	Confident	53 Å²	53	71.5 Å²	71.5	55%	0.546	38%	0.375	S	S	.	.	S	Bend	trans	83	-2.4	-177.5	0	0	0	0	0	115.1	K128 N129	K128-G131 PolarHBondContact O-N 3.32Å; N129-G131 VanDerWaalsContact C-N 3.33Å
132	S	78.3	Confident	73.2	Confident	48 Å²	48	73.9 Å²	73.9	34%	0.336	39%	0.388	S	S	.	.			trans	-71.1	132.8	176.5	64.9	0	0	0	0	111.8	Y127 K128 D130 V134	Y127-S132 CarbonylContact C-O 3.46Å; Y127-S132 VanDerWaalsContact CA-O 3.23Å; Y127-S132 WeakPolarHBondContact CA-O 3.46Å; K128-S132 PolarHBondContact N-O 3.13Å; D130-S132 VanDerWaalsContact C-N 3.32Å; D130-S132 WeakPolarHBondContact OD1-CB 3.37Å; D130-S132 PolarHBondContact OD1-N 2.97Å; D130-S132 PolarHBondContact OD1-OG 3.29Å; S132-V134 PolarHBondContact O-N 3.22Å
133	L	77.1	Confident	72.5	Confident	90 Å²	90	76.2 Å²	76.2	47%	0.471	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	126.1	176.5	-179.7	72.8	0	0	0	110.1	A125 Y127 I136	A125-L133 HydrophobicContact CB-CD1 3.82Å; Y127-L133 HydrophobicContact CD1-CB 4.13Å; Y127-L133 HydrophobicContact CD1-CD1 4.06Å; Y127-L133 HydrophobicContact CE1-CB 4.05Å; Y127-L133 HydrophobicContact CE1-CD1 3.66Å; Y127-L133 HydrophobicContact CE1-CG 4.46Å; Y127-L133 HydrophobicContact CE2-CD1 4.24Å; L133-I136 HydrophobicContact CD1-CD1 4.07Å; L133-I136 HydrophobicContact CD1-CG1 3.77Å; L133-I136 HydrophobicContact CD2-CD1 3.64Å; L133-I136 HydrophobicContact CD2-CG1 3.92Å; L133-I136 HydrophobicContact CG-CD1 4.44Å; L133-I136 HydrophobicContact CG-CG1 4.28Å
134	V	79.4	Confident	71.9	Confident	59 Å²	59	77.7 Å²	77.7	36%	0.358	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	-52	178.8	-176	0	0	0	0	111.2	F108 Y126 K128 S132	F108-V134 HydrophobicContact CE2-CB 4.48Å; F108-V134 HydrophobicContact CE2-CG1 4.35Å; F108-V134 HydrophobicContact CE2-CG2 4.16Å; F108-V134 HydrophobicContact CZ-CB 4.43Å; F108-V134 HydrophobicContact CZ-CG2 3.97Å; Y126-V134 WeakPolarHBondContact O-CB 3.48Å; Y126-V134 PolarHBondContact O-N 3.42Å; K128-V134 HydrophobicContact CB-CG2 4.49Å; K128-V134 HydrophobicContact CD-CG2 4.39Å; K128-V134 HydrophobicContact CG-CG2 3.55Å; S132-V134 PolarHBondContact O-N 3.22Å
135	H	76.7	Confident	71.7	Confident	37 Å²	37	80.7 Å²	80.7	17%	0.171	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	143.9	-169.8	-170.3	-89.1	0	0	0	111	A125 Y126	A125-H135 CarbonylContact C-O 3.42Å; A125-H135 WeakPolarHBondContact CA-O 3.45Å; Y126-H135 HydrophobicContact CD2-CB 4.07Å; Y126-H135 PolarHBondContact N-O 3.03Å; Y126-H135 PolarHBondContact O-N 3.25Å
136	I	76.2	Confident	71.8	Confident	74 Å²	74	84.6 Å²	84.6	38%	0.379	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	119.8	169.3	-64.7	-175.2	0	0	0	108.4	F115 M123 V124 A125 L133	F115-I136 HydrophobicContact CE1-CG2 4.21Å; F115-I136 HydrophobicContact CZ-CD1 4.21Å; F115-I136 HydrophobicContact CZ-CG2 3.82Å; M123-I136 HydrophobicContact CE-CG2 3.64Å; V124-I136 WeakPolarHBondContact O-CA 3.42Å; A125-I136 HydrophobicContact CB-CD1 4.42Å; A125-I136 HydrophobicContact CB-CG1 3.97Å; L133-I136 HydrophobicContact CD1-CD1 4.07Å; L133-I136 HydrophobicContact CD1-CG1 3.77Å; L133-I136 HydrophobicContact CD2-CD1 3.64Å; L133-I136 HydrophobicContact CD2-CG1 3.92Å; L133-I136 HydrophobicContact CG-CD1 4.44Å; L133-I136 HydrophobicContact CG-CG1 4.28Å
137	A	76.1	Confident	72.1	Confident	14 Å²	14	84.4 Å²	84.4	12%	0.116	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	157.7	174.9	0	0	0	0	0	110.3	M123 V124	M123-A137 CarbonylContact C-O 3.13Å; M123-A137 VanDerWaalsContact CA-O 3.26Å; M123-A137 WeakPolarHBondContact CA-O 3.31Å; M123-A137 WeakPolarHBondContact CE-O 3.35Å; V124-A137 PolarHBondContact N-O 3.25Å; V124-A137 PolarHBondContact O-N 2.94Å
138	P	70.7	Confident	72.4	Confident	88 Å²	88	81.9 Å²	81.9	57%	0.571	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-52.2	141.9	151.7	-19.4	32.8	0	0	0	109.4	M123	M123-P138 HydrophobicContact CE-CG 4.46Å; M123-P138 HydrophobicContact SD-CB 4.31Å; M123-P138 HydrophobicContact SD-CG 4.37Å
139	E	65.4	Low	72.8	Confident	44 Å²	44	81.6 Å²	81.6	21%	0.206	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-60.9	125.1	168.4	-169.9	168.5	-130.1	0	0	107.6	R114 R122 V124 E141	R114-E139 VanDerWaalsContact CD-OE1 3.26Å; R114-E139 WeakPolarHBondContact CD-OE1 3.45Å; R114-E139 IonicContact CZ-OE1 2.76Å; R114-E139 IonicContact NE-OE1 2.61Å; R114-E139 PolarHBondContact NE-OE1 3.4Å; R122-E139 HydrophobicContact CB-CB 3.89Å; R122-E139 WeakPolarHBondContact CD-OE2 3.47Å; R122-E139 IonicContact CZ-OE2 2.9Å; R122-E139 IonicContact NE-OE2 3.34Å; R122-E139 PolarHBondContact NE-OE2 3.3Å; R122-E139 IonicContact NH2-OE2 2.73Å; R122-E139 PolarHBondContact O-N 3.25Å; V124-E139 HydrophobicContact CG2-CB 3.68Å; V124-E139 HydrophobicContact CG2-CG 3.72Å; E139-E141 PolarHBondContact O-N 3.47Å; E139-E141 VanDerWaalsContact O-N 3.09Å
140	P	56.1	Low	73.4	Confident	94 Å²	94	76.1 Å²	76.1	61%	0.61	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-58.1	122.5	177.8	23.6	-32.4	0	0	0	107.9	E142	P140-E142 PolarHBondContact O-N 2.96Å
141	E	54.3	Low	74	Confident	166 Å²	166	70.5 Å²	70.5	78%	0.776	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-56.7	130.3	168.8	-65.4	-175.4	172.3	0	0	106.9	E139 E143	E139-E141 PolarHBondContact O-N 3.47Å; E139-E141 VanDerWaalsContact O-N 3.09Å; E141-E143 PolarHBondContact O-N 3.27Å
142	E	54.5	Low	74.8	Confident	189 Å²	189	73.2 Å²	73.2	88%	0.883	37%	0.371	S	S	*	.			trans	-59.2	107.9	172.8	-69	-171.5	149.3	0	0	106.8	P140 E144	P140-E142 PolarHBondContact O-N 2.96Å; E142-E144 VanDerWaalsContact C-N 3.28Å; E142-E144 PolarHBondContact O-N 3.13Å
143	E	58.1	Low	75.3	Confident	185 Å²	185	75.7 Å²	75.7	86%	0.864	38%	0.378	S	S	*	.			trans	-64.5	92.4	-177.9	-75	-165.4	156.7	0	0	108.9	E141 E145	E141-E143 PolarHBondContact O-N 3.27Å; E143-E145 PolarHBondContact O-N 3.07Å
144	E	65.6	Low	75.9	Confident	60 Å²	60	72.5 Å²	72.5	28%	0.28	37%	0.367	S	S	.	.			trans	-56.7	117.2	177.7	180	-178	-150	0	0	108.7	E142 F148 R149 R152	E142-E144 VanDerWaalsContact C-N 3.28Å; E142-E144 PolarHBondContact O-N 3.13Å; E144-F148 HydrophobicContact CG-CB 4.2Å; E144-R149 PolarHBondContact O-NH2 2.74Å; E144-R152 IonicContact OE1-CZ 3.59Å; E144-R152 IonicContact OE1-NH1 2.76Å; E144-R152 PolarHBondContact OE1-NH1 3.32Å; E144-R152 IonicContact OE1-NH2 2.91Å; E144-R152 IonicContact OE2-CZ 3.46Å; E144-R152 IonicContact OE2-NH1 2.71Å; E144-R152 PolarHBondContact OE2-NH1 3.11Å; E144-R152 IonicContact OE2-NH2 2.73Å; E144-R152 PolarHBondContact OE2-NH2 2.88Å
145	E	77.3	Confident	76.4	Confident	70 Å²	70	73 Å²	73	33%	0.327	37%	0.367	S	S	.	.			trans	-48	132.6	-171.1	-165.4	178	155.8	0	0	110.5	E143 L147 F148 R149	E143-E145 PolarHBondContact O-N 3.07Å; E145-L147 PolarHBondContact O-N 3.12Å; E145-F148 HydrophobicContact CB-CB 4.36Å; E145-F148 HydrophobicContact CB-CD2 3.55Å; E145-F148 HydrophobicContact CB-CE2 3.92Å; E145-F148 HydrophobicContact CB-CG 3.97Å; E145-F148 WeakPolarHBondContact O-CB 3.46Å; E145-F148 PolarHBondContact O-N 3.02Å; E145-F148 VanDerWaalsContact OE2-CE2 3.24Å; E145-F148 WeakPolarHBondContact OE2-CE2 3.17Å; E145-F148 VanDerWaalsContact OE2-CZ 3.29Å; E145-F148 WeakPolarHBondContact OE2-CZ 3.27Å; E145-R149 PolarHBondContact O-N 3.43Å
146	P	83.6	Confident	77.1	Confident	81 Å²	81	72.2 Å²	72.2	53%	0.526	37%	0.367	S	S	.	.	H	α-helix	trans	-53.9	-30.2	-174	-29.6	35.6	0	0	0	114	A150 L162	P146-A150 WeakPolarHBondContact O-CB 3.32Å; P146-A150 PolarHBondContact O-N 3.24Å; P146-L162 HydrophobicContact CB-CD1 4.22Å
147	L	85.5	Confident	77.8	Confident	7 Å²	7	74.1 Å²	74.1	4%	0.037	38%	0.378	C	S	.	.	H	α-helix	trans	-66.3	-47.8	173.8	-179.5	62.6	0	0	0	112.4	E145 A150 I151 V159 L162 T168 L170 A180 L196	E145-L147 PolarHBondContact O-N 3.12Å; L147-A150 PolarHBondContact O-N 3.33Å; L147-I151 HydrophobicContact CD1-CD1 4.25Å; L147-I151 HydrophobicContact CG-CD1 4.01Å; L147-I151 VanDerWaalsContact O-CG1 3.27Å; L147-I151 WeakPolarHBondContact O-CG1 3.33Å; L147-I151 PolarHBondContact O-N 2.92Å; L147-V159 HydrophobicContact CD1-CG1 4.11Å; L147-L162 HydrophobicContact CB-CD1 4.46Å; L147-L162 HydrophobicContact CD1-CB 4.08Å; L147-T168 HydrophobicContact CD2-CG2 4.08Å; L147-L170 HydrophobicContact CD2-CD2 3.52Å; L147-A180 HydrophobicContact CD2-CB 4.05Å; L147-L196 HydrophobicContact CD1-CD2 4.49Å
148	F	85.3	Confident	78.3	Confident	21 Å²	21	77.3 Å²	77.3	9%	0.092	39%	0.389	C	S	.	.	H	α-helix	trans	-64.3	-41.1	179	-62.6	-18.2	0	0	0	111.7	E144 E145 I151 R152 A180 Q183	E144-F148 HydrophobicContact CG-CB 4.2Å; E145-F148 HydrophobicContact CB-CB 4.36Å; E145-F148 HydrophobicContact CB-CD2 3.55Å; E145-F148 HydrophobicContact CB-CE2 3.92Å; E145-F148 HydrophobicContact CB-CG 3.97Å; E145-F148 WeakPolarHBondContact O-CB 3.46Å; E145-F148 PolarHBondContact O-N 3.02Å; E145-F148 VanDerWaalsContact OE2-CE2 3.24Å; E145-F148 WeakPolarHBondContact OE2-CE2 3.17Å; E145-F148 VanDerWaalsContact OE2-CZ 3.29Å; E145-F148 WeakPolarHBondContact OE2-CZ 3.27Å; F148-I151 HydrophobicContact CD1-CD1 4.46Å; F148-I151 PolarHBondContact O-N 3.39Å; F148-R152 PolarHBondContact O-N 3.49Å; F148-A180 HydrophobicContact CE1-CB 4.41Å; F148-Q183 VanDerWaalsContact CD1-CD 3.41Å; F148-Q183 VanDerWaalsContact CD2-NE2 3.32Å; F148-Q183 VanDerWaalsContact CE1-NE2 3.31Å
149	R	85.3	Confident	79.2	Confident	101 Å²	101	73.1 Å²	73.1	38%	0.381	36%	0.362	S	S	.	.	H	α-helix	trans	-60	-47	172.3	-167.2	-179.2	-51	166.8	13.2	111.8	E144 E145 I151 R152 E153	E144-R149 PolarHBondContact O-NH2 2.74Å; E145-R149 PolarHBondContact O-N 3.43Å; R149-I151 VanDerWaalsContact C-N 3.31Å; R149-I151 PolarHBondContact O-N 3.03Å; R149-R152 PolarHBondContact O-N 3.37Å; R149-E153 WeakPolarHBondContact CG-OE1 3.43Å; R149-E153 WeakPolarHBondContact O-CB 3.5Å; R149-E153 VanDerWaalsContact O-CG 3.24Å; R149-E153 WeakPolarHBondContact O-CG 3.4Å; R149-E153 PolarHBondContact O-N 3.4Å
150	A	88.3	Confident	80.3	Confident	0 Å²	0	77.2 Å²	77.2	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-63.7	-34.4	177.4	0	0	0	0	0	113.1	P146 L147 G154 N155 K158 V159 L162	P146-A150 WeakPolarHBondContact O-CB 3.32Å; P146-A150 PolarHBondContact O-N 3.24Å; L147-A150 PolarHBondContact O-N 3.33Å; A150-G154 PolarHBondContact O-N 3.46Å; A150-N155 PolarHBondContact O-N 3.12Å; A150-K158 HydrophobicContact CB-CB 4.12Å; A150-K158 HydrophobicContact CB-CD 3.77Å; A150-K158 HydrophobicContact CB-CG 3.76Å; A150-V159 HydrophobicContact CB-CG2 3.82Å; A150-L162 HydrophobicContact CB-CD1 4.24Å
151	I	89.6	Confident	81.8	Confident	0 Å²	0	75.5 Å²	75.5	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-66	-50	172.7	-70	163.1	0	0	0	110.2	L147 F148 R149 E153 G154 V159 A180 Q183 A184 F187 Q189 L196	L147-I151 HydrophobicContact CD1-CD1 4.25Å; L147-I151 HydrophobicContact CG-CD1 4.01Å; L147-I151 VanDerWaalsContact O-CG1 3.27Å; L147-I151 WeakPolarHBondContact O-CG1 3.33Å; L147-I151 PolarHBondContact O-N 2.92Å; F148-I151 HydrophobicContact CD1-CD1 4.46Å; F148-I151 PolarHBondContact O-N 3.39Å; R149-I151 VanDerWaalsContact C-N 3.31Å; R149-I151 PolarHBondContact O-N 3.03Å; I151-E153 VanDerWaalsContact C-N 3.28Å; I151-E153 PolarHBondContact O-N 3.03Å; I151-G154 PolarHBondContact O-N 3.5Å; I151-V159 HydrophobicContact CG1-CG1 4.36Å; I151-V159 HydrophobicContact CG1-CG2 3.69Å; I151-A180 HydrophobicContact CD1-CB 3.74Å; I151-Q183 HydrophobicContact CG2-CB 4.16Å; I151-A184 HydrophobicContact CG2-CB 3.83Å; I151-F187 HydrophobicContact CG2-CD2 4.44Å; I151-Q189 WeakPolarHBondContact O-CG 3.34Å; I151-L196 HydrophobicContact CD1-CD1 3.91Å; I151-L196 HydrophobicContact CG1-CD1 4.38Å
152	R	87.3	Confident	83.4	Confident	109 Å²	109	69.8 Å²	69.8	41%	0.411	34%	0.344	S	S	.	.	H	α-helix	trans	-59.6	-38.7	178.2	-173.6	179.5	67.8	-148	-10.2	112.3	E144 F148 R149 G154 F187	E144-R152 IonicContact OE1-CZ 3.59Å; E144-R152 IonicContact OE1-NH1 2.76Å; E144-R152 PolarHBondContact OE1-NH1 3.32Å; E144-R152 IonicContact OE1-NH2 2.91Å; E144-R152 IonicContact OE2-CZ 3.46Å; E144-R152 IonicContact OE2-NH1 2.71Å; E144-R152 PolarHBondContact OE2-NH1 3.11Å; E144-R152 IonicContact OE2-NH2 2.73Å; E144-R152 PolarHBondContact OE2-NH2 2.88Å; F148-R152 PolarHBondContact O-N 3.49Å; R149-R152 PolarHBondContact O-N 3.37Å; R152-G154 PolarHBondContact O-N 3.43Å; R152-F187 HydrophobicContact CB-CD2 4.3Å; R152-F187 HydrophobicContact CB-CE2 4.05Å; R152-F187 HydrophobicContact CB-CZ 4.24Å; R152-F187 HydrophobicContact CG-CD1 4.27Å; R152-F187 HydrophobicContact CG-CE1 3.9Å; R152-F187 HydrophobicContact CG-CE2 4.17Å; R152-F187 HydrophobicContact CG-CZ 3.85Å
153	E	89.1	Confident	84.8	Confident	101 Å²	101	61.4 Å²	61.4	47%	0.472	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-12.1	173.6	-72.1	167.1	-177.9	0	0	113.7	R149 I151 N155 K158	R149-E153 WeakPolarHBondContact CG-OE1 3.43Å; R149-E153 WeakPolarHBondContact O-CB 3.5Å; R149-E153 VanDerWaalsContact O-CG 3.24Å; R149-E153 WeakPolarHBondContact O-CG 3.4Å; R149-E153 PolarHBondContact O-N 3.4Å; I151-E153 VanDerWaalsContact C-N 3.28Å; I151-E153 PolarHBondContact O-N 3.03Å; E153-N155 VanDerWaalsContact C-N 3.25Å; E153-N155 PolarHBondContact O-N 3.4Å; E153-K158 IonicContact OE2-NZ 2.66Å; E153-K158 PolarHBondContact OE2-NZ 3.35Å
154	G	88.9	Confident	85.9	Confident	23 Å²	23	58.2 Å²	58.2	24%	0.237	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.6	14.9	-176.1	0	0	0	0	0	115	A150 I151 R152 A156	A150-G154 PolarHBondContact O-N 3.46Å; I151-G154 PolarHBondContact O-N 3.5Å; R152-G154 PolarHBondContact O-N 3.43Å; G154-A156 PolarHBondContact O-N 3.32Å
155	N	91.6	Very high	86.8	Confident	68 Å²	68	58 Å²	58	36%	0.364	30%	0.299	S	S	.	.			trans	-83	80.3	-173.6	-168.8	-29.9	0	0	0	111.4	A150 E153 N157 K158 V159	A150-N155 PolarHBondContact O-N 3.12Å; E153-N155 VanDerWaalsContact C-N 3.25Å; E153-N155 PolarHBondContact O-N 3.4Å; N155-N157 PolarHBondContact O-N 3.09Å; N155-N157 VanDerWaalsContact O-N 3.14Å; N155-N157 PolarHBondContact OD1-N 3.47Å; N155-K158 HydrophobicContact CB-CB 3.96Å; N155-K158 HydrophobicContact CB-CD 4.47Å; N155-K158 VanDerWaalsContact CG-CB 3.46Å; N155-K158 PolarHBondContact O-N 3.01Å; N155-K158 WeakPolarHBondContact OD1-CB 3.5Å; N155-K158 PolarHBondContact OD1-N 3.26Å; N155-V159 WeakPolarHBondContact O-CG2 3.35Å; N155-V159 PolarHBondContact O-N 2.8Å
156	A	89.9	Confident	86.2	Confident	21 Å²	21	61.7 Å²	61.7	17%	0.174	33%	0.328	C	S	.	.	H	α-helix	trans	-56.2	-30.7	-177.2	0	0	0	0	0	114	G154 R160 M195	G154-A156 PolarHBondContact O-N 3.32Å; A156-R160 WeakPolarHBondContact O-CB 3.13Å; A156-R160 PolarHBondContact O-N 3.35Å; A156-M195 HydrophobicContact CB-CG 4.5Å
157	N	90.6	Very high	85.5	Confident	115 Å²	115	61.4 Å²	61.4	62%	0.615	34%	0.34	S	S	*	.	H	α-helix	trans	-70.2	-42.6	176.2	-71.1	-26.4	0	0	0	112	N155 R160 A161	N155-N157 PolarHBondContact O-N 3.09Å; N155-N157 VanDerWaalsContact O-N 3.14Å; N155-N157 PolarHBondContact OD1-N 3.47Å; N157-R160 WeakPolarHBondContact O-CB 3.35Å; N157-R160 PolarHBondContact O-N 3.28Å; N157-A161 PolarHBondContact O-N 3.44Å
158	K	88.2	Confident	85.2	Confident	80 Å²	80	63 Å²	63	35%	0.348	35%	0.35	S	S	.	.	H	α-helix	trans	-67.8	-38.7	174.9	-171.5	176.6	172.1	-171.5	0	111.1	A150 E153 N155 A161 L162	A150-K158 HydrophobicContact CB-CB 4.12Å; A150-K158 HydrophobicContact CB-CD 3.77Å; A150-K158 HydrophobicContact CB-CG 3.76Å; E153-K158 IonicContact OE2-NZ 2.66Å; E153-K158 PolarHBondContact OE2-NZ 3.35Å; N155-K158 HydrophobicContact CB-CB 3.96Å; N155-K158 HydrophobicContact CB-CD 4.47Å; N155-K158 VanDerWaalsContact CG-CB 3.46Å; N155-K158 PolarHBondContact O-N 3.01Å; N155-K158 WeakPolarHBondContact OD1-CB 3.5Å; N155-K158 PolarHBondContact OD1-N 3.26Å; K158-A161 PolarHBondContact O-N 3.23Å; K158-L162 HydrophobicContact CG-CD1 4.19Å; K158-L162 WeakPolarHBondContact O-CB 3.2Å; K158-L162 VanDerWaalsContact O-CG 3.29Å; K158-L162 WeakPolarHBondContact O-CG 3.28Å; K158-L162 PolarHBondContact O-N 3.27Å
159	V	89	Confident	85.1	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-62.3	-45.7	171.6	174.1	0	0	0	0	111.3	L147 A150 I151 N155 A161 L162 A163 C192 L196	L147-V159 HydrophobicContact CD1-CG1 4.11Å; A150-V159 HydrophobicContact CB-CG2 3.82Å; I151-V159 HydrophobicContact CG1-CG1 4.36Å; I151-V159 HydrophobicContact CG1-CG2 3.69Å; N155-V159 WeakPolarHBondContact O-CG2 3.35Å; N155-V159 PolarHBondContact O-N 2.8Å; V159-A161 PolarHBondContact O-N 2.9Å; V159-L162 PolarHBondContact O-N 3.46Å; V159-A163 WeakPolarHBondContact O-CB 3.44Å; V159-A163 PolarHBondContact O-N 3.3Å; V159-C192 HydrophobicContact CG1-CB 4.42Å; V159-C192 HydrophobicContact CG2-CB 4.33Å; V159-L196 HydrophobicContact CG1-CD1 4.44Å; V159-L196 HydrophobicContact CG1-CD2 3.91Å; V159-L196 HydrophobicContact CG1-CG 3.89Å
160	R	89.1	Confident	85	Confident	130 Å²	130	62.5 Å²	62.5	49%	0.491	36%	0.356	S	S	.	.	H	α-helix	trans	-56.1	-48.4	173.8	175.3	-177.3	-63.5	-177.4	-2.5	111.7	A156 N157 M164 M195	A156-R160 WeakPolarHBondContact O-CB 3.13Å; A156-R160 PolarHBondContact O-N 3.35Å; N157-R160 WeakPolarHBondContact O-CB 3.35Å; N157-R160 PolarHBondContact O-N 3.28Å; R160-M164 VanDerWaalsContact O-CG 3.27Å; R160-M164 WeakPolarHBondContact O-CG 3.48Å; R160-M164 PolarHBondContact O-N 2.88Å; R160-M195 HydrophobicContact CB-CE 3.78Å; R160-M195 HydrophobicContact CB-CG 4.25Å; R160-M195 HydrophobicContact CB-SD 4.36Å; R160-M195 HydrophobicContact CG-CE 3.57Å; R160-M195 PolarHBondContact NE-SD 3.4Å; R160-M195 PolarHBondContact NH2-SD 2.96Å
161	A	87.6	Confident	84.8	Confident	59 Å²	59	65.4 Å²	65.4	49%	0.488	37%	0.37	S	S	.	.	H	α-helix	trans	-61.4	-49.3	179.8	0	0	0	0	0	111.7	N157 K158 V159 A163 M164 C165	N157-A161 PolarHBondContact O-N 3.44Å; K158-A161 PolarHBondContact O-N 3.23Å; V159-A161 PolarHBondContact O-N 2.9Å; A161-A163 PolarHBondContact O-N 2.99Å; A161-M164 PolarHBondContact O-N 3.3Å; A161-C165 PolarHBondContact O-N 2.73Å; A161-C165 PolarHBondContact O-SG 3.05Å
162	L	86.6	Confident	84.5	Confident	45 Å²	45	70.6 Å²	70.6	24%	0.236	40%	0.397	C	S	.	.	H	α-helix	trans	-67.1	-35.4	-179.2	-68.7	171.5	0	0	0	112.8	P146 L147 A150 K158 V159 M164 C165 T168	P146-L162 HydrophobicContact CB-CD1 4.22Å; L147-L162 HydrophobicContact CB-CD1 4.46Å; L147-L162 HydrophobicContact CD1-CB 4.08Å; A150-L162 HydrophobicContact CB-CD1 4.24Å; K158-L162 HydrophobicContact CG-CD1 4.19Å; K158-L162 WeakPolarHBondContact O-CB 3.2Å; K158-L162 VanDerWaalsContact O-CG 3.29Å; K158-L162 WeakPolarHBondContact O-CG 3.28Å; K158-L162 PolarHBondContact O-N 3.27Å; V159-L162 PolarHBondContact O-N 3.46Å; L162-M164 VanDerWaalsContact C-N 3.3Å; L162-M164 PolarHBondContact O-N 3.32Å; L162-C165 WeakPolarHBondContact O-CB 3.41Å; L162-C165 PolarHBondContact O-N 3.45Å; L162-T168 VanDerWaalsContact O-CB 3.24Å; L162-T168 WeakPolarHBondContact O-CB 3.47Å; L162-T168 PolarHBondContact O-OG1 2.95Å
163	A	84.5	Confident	84.3	Confident	13 Å²	13	68.9 Å²	68.9	11%	0.107	40%	0.401	C	S	.	.	H	α-helix	trans	-70.2	-24.6	177.8	0	0	0	0	0	113.5	V159 A161 L170 A199	V159-A163 WeakPolarHBondContact O-CB 3.44Å; V159-A163 PolarHBondContact O-N 3.3Å; A161-A163 PolarHBondContact O-N 2.99Å; A163-L170 HydrophobicContact CB-CD1 4.2Å; A163-L170 HydrophobicContact CB-CD2 4.33Å; A163-A199 HydrophobicContact CB-CB 4.21Å
164	M	81.8	Confident	83.9	Confident	118 Å²	118	65.8 Å²	65.8	58%	0.581	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-1.3	177.8	-64.2	-67.9	169.2	0	0	113.1	R160 A161 L162 A199	R160-M164 VanDerWaalsContact O-CG 3.27Å; R160-M164 WeakPolarHBondContact O-CG 3.48Å; R160-M164 PolarHBondContact O-N 2.88Å; A161-M164 PolarHBondContact O-N 3.3Å; L162-M164 VanDerWaalsContact C-N 3.3Å; L162-M164 PolarHBondContact O-N 3.32Å; M164-A199 HydrophobicContact CE-CB 3.99Å
165	C	83.6	Confident	83.1	Confident	57 Å²	57	74.5 Å²	74.5	39%	0.385	42%	0.422	S	S	.	.	S	Bend	trans	-70.5	129.3	175.8	-71	0	0	0	0	110.9	A161 L162 G167 T168	A161-C165 PolarHBondContact O-N 2.73Å; A161-C165 PolarHBondContact O-SG 3.05Å; L162-C165 WeakPolarHBondContact O-CB 3.41Å; L162-C165 PolarHBondContact O-N 3.45Å; C165-G167 PolarHBondContact O-N 3.18Å; C165-T168 WeakPolarHBondContact CB-OG1 3.18Å; C165-T168 PolarHBondContact O-N 3.32Å; C165-T168 VanDerWaalsContact O-N 3.08Å
166	P	64.3	Low	82.2	Confident	147 Å²	147	74.8 Å²	74.8	96%	0.955	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	2.8	-176.4	-27.2	35.6	0	0	0	118.1
167	G	70	Confident	82	Confident	75 Å²	75	74.4 Å²	74.4	77%	0.773	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.1	-3.6	176.8	0	0	0	0	0	115	C165 N169	C165-G167 PolarHBondContact O-N 3.18Å; G167-N169 PolarHBondContact O-N 3.21Å
168	T	79.8	Confident	81.9	Confident	40 Å²	40	70.5 Å²	70.5	25%	0.245	40%	0.402	C	S	.	.			trans	-81.5	104.2	-177.1	-53.8	0	0	0	0	111.2	L147 L162 C165 L170	L147-T168 HydrophobicContact CD2-CG2 4.08Å; L162-T168 VanDerWaalsContact O-CB 3.24Å; L162-T168 WeakPolarHBondContact O-CB 3.47Å; L162-T168 PolarHBondContact O-OG1 2.95Å; C165-T168 WeakPolarHBondContact CB-OG1 3.18Å; C165-T168 PolarHBondContact O-N 3.32Å; C165-T168 VanDerWaalsContact O-N 3.08Å; T168-L170 HydrophobicContact CG2-CD2 3.93Å; T168-L170 PolarHBondContact O-N 3.01Å; T168-L170 VanDerWaalsContact O-N 3.12Å
169	N	81.9	Confident	82.1	Confident	96 Å²	96	67.1 Å²	67.1	51%	0.513	39%	0.388	S	S	.	.			trans	-84	88.5	177.4	-173.4	-2.2	0	0	0	112	G167 M171 L172	G167-N169 PolarHBondContact O-N 3.21Å; N169-M171 PolarHBondContact O-N 3.02Å; N169-M171 WeakPolarHBondContact OD1-CB 3.35Å; N169-M171 PolarHBondContact OD1-N 3.34Å; N169-L172 HydrophobicContact CB-CB 4.34Å; N169-L172 WeakPolarHBondContact O-CB 3.23Å; N169-L172 PolarHBondContact O-N 3.21Å
170	L	83.9	Confident	82.2	Confident	16 Å²	16	67.2 Å²	67.2	8%	0.084	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-19.7	176.9	-59.4	178	0	0	0	114.1	L147 A163 T168 L196 A199 Q200 M203	L147-L170 HydrophobicContact CD2-CD2 3.52Å; A163-L170 HydrophobicContact CB-CD1 4.2Å; A163-L170 HydrophobicContact CB-CD2 4.33Å; T168-L170 HydrophobicContact CG2-CD2 3.93Å; T168-L170 PolarHBondContact O-N 3.01Å; T168-L170 VanDerWaalsContact O-N 3.12Å; L170-L196 HydrophobicContact CD2-CD2 4.01Å; L170-A199 HydrophobicContact CD1-CB 4.04Å; L170-Q200 HydrophobicContact CD1-CB 4.11Å; L170-M203 HydrophobicContact CB-CE 3.96Å; L170-M203 HydrophobicContact CB-SD 3.7Å; L170-M203 HydrophobicContact CD1-SD 4.41Å; L170-M203 WeakPolarHBondContact O-CE 3.37Å
171	M	84.1	Confident	82.4	Confident	61 Å²	61	61 Å²	61	30%	0.3	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-3.2	179.3	-63	-61.4	-51.5	0	0	113.7	N169 P173 L179 Q200 M203 K206	N169-M171 PolarHBondContact O-N 3.02Å; N169-M171 WeakPolarHBondContact OD1-CB 3.35Å; N169-M171 PolarHBondContact OD1-N 3.34Å; M171-P173 WeakPolarHBondContact O-CD 3.35Å; M171-L179 HydrophobicContact CE-CD1 4.5Å; M171-L179 WeakPolarHBondContact O-CD2 3.15Å; M171-Q200 HydrophobicContact SD-CG 3.96Å; M171-M203 HydrophobicContact SD-CG 3.46Å; M171-M203 WeakPolarHBondContact SD-CG 3.48Å; M171-M203 HydrophobicContact SD-SD 4.35Å; M171-K206 HydrophobicContact CE-CD 4Å; M171-K206 HydrophobicContact CE-CG 4.07Å
172	L	82.9	Confident	82.7	Confident	108 Å²	108	58.2 Å²	58.2	57%	0.565	34%	0.342	S	S	*	.	P	Polyproline II helix	trans	-76.4	119.2	177.8	-172.2	69.3	0	0	0	110.3	N169	N169-L172 HydrophobicContact CB-CB 4.34Å; N169-L172 WeakPolarHBondContact O-CB 3.23Å; N169-L172 PolarHBondContact O-N 3.21Å
173	P	82.4	Confident	82.9	Confident	74 Å²	74	56.9 Å²	56.9	48%	0.481	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-80.6	128.2	178	30.8	-32.3	0	0	0	111.7	M171 W178 L179	M171-P173 WeakPolarHBondContact O-CD 3.35Å; P173-W178 CarbonylContact C-O 3.44Å; P173-W178 WeakPolarHBondContact CA-O 3.5Å; P173-L179 HydrophobicContact CB-CD2 4.21Å
174	S	81.9	Confident	83.4	Confident	36 Å²	36	56.3 Å²	56.3	25%	0.252	33%	0.329	S	S	.	.	B	Isolated β-bridge	trans	-69.5	164.1	161.4	77.8	0	0	0	0	110.1	G177 W178	S174-G177 CarbonylContact O-C 3.55Å; S174-G177 VanDerWaalsContact O-CA 3.25Å; S174-G177 WeakPolarHBondContact O-CA 3.3Å; S174-G177 PolarHBondContact O-N 3.2Å; S174-W178 PolarHBondContact N-O 3.11Å; S174-W178 PolarHBondContact O-N 3.23Å; S174-W178 PolarHBondContact OG-O 3.18Å
175	K	71.4	Confident	84	Confident	206 Å²	206	50.7 Å²	50.7	90%	0.896	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	124.3	167.5	-65.1	177.5	-178.8	175.3	0	107.8
176	P	73.8	Confident	84.5	Confident	73 Å²	73	52 Å²	52	47%	0.474	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	cis	-108.1	70.4	18.9	39.9	-32.4	0	0	0	114.3	S209	P176-S209 VanDerWaalsContact C-OG 3.27Å; P176-S209 VanDerWaalsContact O-CB 3.26Å; P176-S209 WeakPolarHBondContact O-CB 3.23Å; P176-S209 PolarHBondContact O-N 3.08Å; P176-S209 VanDerWaalsContact O-N 3.12Å; P176-S209 PolarHBondContact O-OG 2.71Å
177	G	83.8	Confident	85.8	Confident	14 Å²	14	48.8 Å²	48.8	14%	0.144	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	82	18	-179.5	0	0	0	0	0	114.5	S174 T208 S209	S174-G177 CarbonylContact O-C 3.55Å; S174-G177 VanDerWaalsContact O-CA 3.25Å; S174-G177 WeakPolarHBondContact O-CA 3.3Å; S174-G177 PolarHBondContact O-N 3.2Å; G177-T208 WeakPolarHBondContact O-CA 3.46Å; G177-S209 WeakPolarHBondContact CA-OG 3.27Å; G177-S209 PolarHBondContact N-OG 2.79Å
178	W	89.6	Confident	87	Confident	33 Å²	33	46.1 Å²	46.1	13%	0.125	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-90.6	135.9	-169.7	-81.2	38.9	0	0	0	112.8	P173 S174 H182 Q183 W186 T208 V217	P173-W178 CarbonylContact C-O 3.44Å; P173-W178 WeakPolarHBondContact CA-O 3.5Å; S174-W178 PolarHBondContact N-O 3.11Å; S174-W178 PolarHBondContact O-N 3.23Å; S174-W178 PolarHBondContact OG-O 3.18Å; W178-H182 HydrophobicContact CB-CB 4.4Å; W178-H182 HydrophobicContact CD2-CB 4.03Å; W178-H182 HydrophobicContact CE3-CB 3.96Å; W178-H182 HydrophobicContact CG-CB 4.23Å; W178-Q183 HydrophobicContact CE3-CG 3.73Å; W178-Q183 HydrophobicContact CZ3-CG 4.27Å; W178-W186 HydrophobicContact CH2-CB 3.87Å; W178-W186 AromaticContact CH2-CD2 3.49Å; W178-W186 HydrophobicContact CH2-CD2 3.49Å; W178-W186 VanDerWaalsContact CH2-CD2 3.49Å; W178-W186 AromaticContact CH2-CE2 3.91Å; W178-W186 AromaticContact CH2-CE3 3.54Å; W178-W186 HydrophobicContact CH2-CE3 3.54Å; W178-W186 AromaticContact CH2-CG 3.73Å; W178-W186 HydrophobicContact CH2-CG 3.73Å; W178-W186 HydrophobicContact CH2-CH2 4.21Å; W178-W186 HydrophobicContact CH2-CZ2 4.23Å; W178-W186 AromaticContact CH2-CZ3 3.91Å; W178-W186 HydrophobicContact CH2-CZ3 3.91Å; W178-W186 HydrophobicContact CZ2-CE3 4.21Å; W178-W186 HydrophobicContact CZ2-CZ3 4.21Å; W178-W186 HydrophobicContact CZ3-CB 3.74Å; W178-W186 HydrophobicContact CZ3-CD2 4.15Å; W178-W186 AromaticContact CZ3-CG 3.88Å; W178-W186 HydrophobicContact CZ3-CG 3.88Å; W178-T208 HydrophobicContact CG-CG2 4.25Å; W178-V217 HydrophobicContact CH2-CG1 4.44Å
179	L	92	Very high	87.7	Confident	9 Å²	9	46.5 Å²	46.5	5%	0.047	24%	0.242	C	C	.	.			trans	-98.7	165.1	169.6	-55.9	176.2	0	0	0	110.8	M171 P173 V181 H182 Q183 M203 K206	M171-L179 HydrophobicContact CE-CD1 4.5Å; M171-L179 WeakPolarHBondContact O-CD2 3.15Å; P173-L179 HydrophobicContact CB-CD2 4.21Å; L179-V181 HydrophobicContact CB-CG2 4.09Å; L179-V181 PolarHBondContact O-N 3.3Å; L179-V181 VanDerWaalsContact O-N 3.12Å; L179-H182 PolarHBondContact N-ND1 3.19Å; L179-H182 WeakPolarHBondContact O-CB 3.45Å; L179-H182 PolarHBondContact O-N 2.88Å; L179-Q183 PolarHBondContact O-N 3.5Å; L179-M203 HydrophobicContact CB-CE 3.77Å; L179-M203 HydrophobicContact CD1-CE 4.15Å; L179-M203 HydrophobicContact CD1-CG 4.41Å; L179-M203 HydrophobicContact CG-CE 4.48Å; L179-K206 HydrophobicContact CD1-CB 3.61Å; L179-K206 HydrophobicContact CD1-CG 3.94Å
180	A	90.7	Very high	88.3	Confident	2 Å²	2	44.5 Å²	44.5	2%	0.017	23%	0.231	C	C	.	.	H	α-helix	trans	-48.2	-40.4	174.6	0	0	0	0	0	113.6	L147 F148 I151 H182 Q183 A184 L196 M203	L147-A180 HydrophobicContact CD2-CB 4.05Å; F148-A180 HydrophobicContact CE1-CB 4.41Å; I151-A180 HydrophobicContact CD1-CB 3.74Å; A180-H182 VanDerWaalsContact C-N 3.33Å; A180-H182 PolarHBondContact O-N 3.07Å; A180-Q183 PolarHBondContact O-N 3.25Å; A180-A184 PolarHBondContact O-N 3.39Å; A180-L196 HydrophobicContact CB-CD1 3.88Å; A180-L196 HydrophobicContact CB-CD2 3.81Å; A180-L196 HydrophobicContact CB-CG 4.49Å; A180-M203 HydrophobicContact CB-CE 4.3Å
181	V	93.4	Very high	88.8	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-64.1	-32.4	176.6	-67	0	0	0	0	113.7	L179 A185 L193 L196 L197 M203 P214	L179-V181 HydrophobicContact CB-CG2 4.09Å; L179-V181 PolarHBondContact O-N 3.3Å; L179-V181 VanDerWaalsContact O-N 3.12Å; V181-A185 WeakPolarHBondContact O-CB 3.36Å; V181-A185 PolarHBondContact O-N 2.9Å; V181-L193 HydrophobicContact CB-CD1 3.86Å; V181-L193 HydrophobicContact CG1-CD1 4Å; V181-L196 HydrophobicContact CG1-CB 3.89Å; V181-L196 HydrophobicContact CG1-CD1 4.39Å; V181-L197 HydrophobicContact CG1-CD2 4.07Å; V181-L197 HydrophobicContact CG1-CG 4.48Å; V181-M203 HydrophobicContact CB-CE 4.48Å; V181-M203 HydrophobicContact CG1-CB 3.95Å; V181-M203 HydrophobicContact CG1-CE 3.91Å; V181-M203 HydrophobicContact CG1-SD 4.28Å; V181-M203 HydrophobicContact CG2-CB 3.92Å; V181-M203 HydrophobicContact CG2-CE 4.05Å; V181-P214 HydrophobicContact CB-CB 4.41Å; V181-P214 HydrophobicContact CB-CG 4.18Å; V181-P214 HydrophobicContact CG2-CB 4.26Å; V181-P214 HydrophobicContact CG2-CG 3.53Å
182	H	93.8	Very high	89.2	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-71.9	-37.9	177.3	-62.2	92.1	0	0	0	110.8	W178 L179 A180 A185 W186 K206 T208 E212 P214	W178-H182 HydrophobicContact CB-CB 4.4Å; W178-H182 HydrophobicContact CD2-CB 4.03Å; W178-H182 HydrophobicContact CE3-CB 3.96Å; W178-H182 HydrophobicContact CG-CB 4.23Å; L179-H182 PolarHBondContact N-ND1 3.19Å; L179-H182 WeakPolarHBondContact O-CB 3.45Å; L179-H182 PolarHBondContact O-N 2.88Å; A180-H182 VanDerWaalsContact C-N 3.33Å; A180-H182 PolarHBondContact O-N 3.07Å; H182-A185 PolarHBondContact O-N 3.22Å; H182-W186 WeakPolarHBondContact O-CB 3.46Å; H182-W186 PolarHBondContact O-N 3.45Å; H182-K206 PolarHBondContact NE2-O 2.91Å; H182-T208 WeakPolarHBondContact CD2-CG2 3.29Å; H182-E212 PolarHBondContact NE2-O 2.68Å; H182-P214 WeakPolarHBondContact NE2-CD 3.49Å
183	Q	91.1	Very high	89.8	Confident	17 Å²	17	38.5 Å²	38.5	8%	0.079	21%	0.206	C	C	.	.	H	α-helix	trans	-66.3	-46	174	-65.3	-176.3	21.3	0	0	111.6	F148 I151 W178 L179 A180 A185 W186 F187	F148-Q183 VanDerWaalsContact CD1-CD 3.41Å; F148-Q183 VanDerWaalsContact CD2-NE2 3.32Å; F148-Q183 VanDerWaalsContact CE1-NE2 3.31Å; I151-Q183 HydrophobicContact CG2-CB 4.16Å; W178-Q183 HydrophobicContact CE3-CG 3.73Å; W178-Q183 HydrophobicContact CZ3-CG 4.27Å; L179-Q183 PolarHBondContact O-N 3.5Å; A180-Q183 PolarHBondContact O-N 3.25Å; Q183-A185 VanDerWaalsContact C-N 3.32Å; Q183-A185 PolarHBondContact O-N 3.34Å; Q183-W186 PolarHBondContact O-N 3.17Å; Q183-W186 VanDerWaalsContact O-N 3.17Å; Q183-F187 HydrophobicContact CB-CD2 4.37Å; Q183-F187 HydrophobicContact CB-CE2 4.4Å; Q183-F187 WeakPolarHBondContact O-CD2 3.47Å; Q183-F187 PolarHBondContact O-N 2.95Å
184	A	94.2	Very high	90.4	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-60.9	-42	176.3	0	0	0	0	0	111.6	I151 A180 W186 G188 Q189 C192 L193 L196	I151-A184 HydrophobicContact CG2-CB 3.83Å; A180-A184 PolarHBondContact O-N 3.39Å; A184-W186 PolarHBondContact O-N 2.91Å; A184-G188 PolarHBondContact O-N 3.21Å; A184-G188 VanDerWaalsContact O-N 3.13Å; A184-Q189 HydrophobicContact CB-CB 4.49Å; A184-Q189 PolarHBondContact O-N 3.39Å; A184-C192 HydrophobicContact CB-CB 4.44Å; A184-L193 HydrophobicContact CB-CB 4.15Å; A184-L193 HydrophobicContact CB-CD1 4.07Å; A184-L196 HydrophobicContact CB-CD1 4Å
185	A	95.2	Very high	90.9	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.1	-40.2	172.9	0	0	0	0	0	113.3	V181 H182 Q183 P214 V217 A218 Q223 L230	V181-A185 WeakPolarHBondContact O-CB 3.36Å; V181-A185 PolarHBondContact O-N 2.9Å; H182-A185 PolarHBondContact O-N 3.22Å; Q183-A185 VanDerWaalsContact C-N 3.32Å; Q183-A185 PolarHBondContact O-N 3.34Å; A185-P214 HydrophobicContact CB-CB 4.31Å; A185-P214 VanDerWaalsContact CB-O 3.3Å; A185-P214 WeakPolarHBondContact CB-O 3.42Å; A185-V217 HydrophobicContact CB-CB 4.41Å; A185-V217 HydrophobicContact CB-CG1 4.23Å; A185-A218 HydrophobicContact CB-CB 4.05Å; A185-Q223 WeakPolarHBondContact O-CG 3.39Å; A185-L230 HydrophobicContact CB-CD1 4.4Å
186	W	93.7	Very high	91.9	Very high	85 Å²	85	29.5 Å²	29.5	32%	0.322	15%	0.152	S	C	.	.	H	α-helix	trans	-70.3	-44.5	179.1	175.8	-97.6	0	0	0	113.4	W178 H182 Q183 A184 G188 V217 R221 Q223	W178-W186 HydrophobicContact CH2-CB 3.87Å; W178-W186 AromaticContact CH2-CD2 3.49Å; W178-W186 HydrophobicContact CH2-CD2 3.49Å; W178-W186 VanDerWaalsContact CH2-CD2 3.49Å; W178-W186 AromaticContact CH2-CE2 3.91Å; W178-W186 AromaticContact CH2-CE3 3.54Å; W178-W186 HydrophobicContact CH2-CE3 3.54Å; W178-W186 AromaticContact CH2-CG 3.73Å; W178-W186 HydrophobicContact CH2-CG 3.73Å; W178-W186 HydrophobicContact CH2-CH2 4.21Å; W178-W186 HydrophobicContact CH2-CZ2 4.23Å; W178-W186 AromaticContact CH2-CZ3 3.91Å; W178-W186 HydrophobicContact CH2-CZ3 3.91Å; W178-W186 HydrophobicContact CZ2-CE3 4.21Å; W178-W186 HydrophobicContact CZ2-CZ3 4.21Å; W178-W186 HydrophobicContact CZ3-CB 3.74Å; W178-W186 HydrophobicContact CZ3-CD2 4.15Å; W178-W186 AromaticContact CZ3-CG 3.88Å; W178-W186 HydrophobicContact CZ3-CG 3.88Å; H182-W186 WeakPolarHBondContact O-CB 3.46Å; H182-W186 PolarHBondContact O-N 3.45Å; Q183-W186 PolarHBondContact O-N 3.17Å; Q183-W186 VanDerWaalsContact O-N 3.17Å; A184-W186 PolarHBondContact O-N 2.91Å; W186-G188 VanDerWaalsContact C-N 3.27Å; W186-G188 PolarHBondContact O-N 2.98Å; W186-V217 HydrophobicContact CB-CG1 3.81Å; W186-V217 HydrophobicContact CE3-CG1 4.03Å; W186-R221 HydrophobicContact CD2-CG 3.93Å; W186-R221 VanDerWaalsContact CE2-CZ 3.5Å; W186-R221 HydrophobicContact CE3-CG 3.51Å; W186-R221 HydrophobicContact CG-CG 4.41Å; W186-R221 VanDerWaalsContact CZ2-CZ 3.49Å; W186-R221 HydrophobicContact CZ3-CG 4.25Å; W186-Q223 PolarHBondContact O-NE2 3.42Å
187	F	92.8	Very high	92.7	Very high	79 Å²	79	26.1 Å²	26.1	35%	0.346	13%	0.13	S	C	.	.	H	α-helix	trans	-78.2	-6.5	179.9	-69.2	-62	0	0	0	113.7	I151 R152 Q183 Q189	I151-F187 HydrophobicContact CG2-CD2 4.44Å; R152-F187 HydrophobicContact CB-CD2 4.3Å; R152-F187 HydrophobicContact CB-CE2 4.05Å; R152-F187 HydrophobicContact CB-CZ 4.24Å; R152-F187 HydrophobicContact CG-CD1 4.27Å; R152-F187 HydrophobicContact CG-CE1 3.9Å; R152-F187 HydrophobicContact CG-CE2 4.17Å; R152-F187 HydrophobicContact CG-CZ 3.85Å; Q183-F187 HydrophobicContact CB-CD2 4.37Å; Q183-F187 HydrophobicContact CB-CE2 4.4Å; Q183-F187 WeakPolarHBondContact O-CD2 3.47Å; Q183-F187 PolarHBondContact O-N 2.95Å; F187-Q189 HydrophobicContact CB-CG 3.76Å
188	G	93.9	Very high	93.1	Very high	20 Å²	20	29 Å²	29	21%	0.206	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.6	23.7	178.9	0	0	0	0	0	114.6	A184 W186 D190	A184-G188 PolarHBondContact O-N 3.21Å; A184-G188 VanDerWaalsContact O-N 3.13Å; W186-G188 VanDerWaalsContact C-N 3.27Å; W186-G188 PolarHBondContact O-N 2.98Å; G188-D190 PolarHBondContact O-N 3.47Å
189	Q	95.1	Very high	93.1	Very high	47 Å²	47	28.9 Å²	28.9	22%	0.22	15%	0.154	C	C	.	.			trans	-95.1	71.8	-168.2	-60.6	-72.1	1.8	0	0	111	I151 A184 F187 S191 C192 L193 C226	I151-Q189 WeakPolarHBondContact O-CG 3.34Å; A184-Q189 HydrophobicContact CB-CB 4.49Å; A184-Q189 PolarHBondContact O-N 3.39Å; F187-Q189 HydrophobicContact CB-CG 3.76Å; Q189-S191 VanDerWaalsContact C-N 3.31Å; Q189-S191 PolarHBondContact O-N 3.14Å; Q189-C192 HydrophobicContact CB-CB 3.95Å; Q189-C192 WeakPolarHBondContact O-CB 3.45Å; Q189-C192 PolarHBondContact O-N 2.86Å; Q189-L193 WeakPolarHBondContact O-CB 3.23Å; Q189-L193 PolarHBondContact O-N 2.75Å; Q189-C226 PolarHBondContact N-SG 3Å
190	D	94.3	Very high	93	Very high	54 Å²	54	32.2 Å²	32.2	29%	0.289	17%	0.17	S	C	.	.	H	α-helix	trans	-56.9	-40.8	-175	81.7	-54.2	0	0	0	112.7	G188 L193 R194 V229	G188-D190 PolarHBondContact O-N 3.47Å; D190-L193 WeakPolarHBondContact O-CB 3.49Å; D190-L193 PolarHBondContact O-N 2.78Å; D190-L193 VanDerWaalsContact O-N 3.17Å; D190-R194 WeakPolarHBondContact O-CG 3.44Å; D190-R194 PolarHBondContact O-N 3Å; D190-V229 HydrophobicContact CB-CG2 4Å
191	S	94.3	Very high	92.9	Very high	60 Å²	60	36.2 Å²	36.2	42%	0.42	20%	0.195	S	C	.	.	H	α-helix	trans	-68.3	-40.1	179.3	-67.1	0	0	0	0	112	Q189 L193 M195	Q189-S191 VanDerWaalsContact C-N 3.31Å; Q189-S191 PolarHBondContact O-N 3.14Å; S191-L193 VanDerWaalsContact C-N 3.3Å; S191-M195 WeakPolarHBondContact O-CG 3.48Å; S191-M195 PolarHBondContact O-N 3.06Å
192	C	93.3	Very high	92.7	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-65	-37.1	170.8	-65.1	0	0	0	0	111.2	V159 A184 Q189 M195 L196	V159-C192 HydrophobicContact CG1-CB 4.42Å; V159-C192 HydrophobicContact CG2-CB 4.33Å; A184-C192 HydrophobicContact CB-CB 4.44Å; Q189-C192 HydrophobicContact CB-CB 3.95Å; Q189-C192 WeakPolarHBondContact O-CB 3.45Å; Q189-C192 PolarHBondContact O-N 2.86Å; C192-M195 WeakPolarHBondContact O-CB 3.25Å; C192-M195 PolarHBondContact O-N 3.21Å; C192-L196 WeakPolarHBondContact O-CG 3.47Å; C192-L196 PolarHBondContact O-N 3.26Å
193	L	94.5	Very high	92.7	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-68.1	-44.3	-179.7	-168.5	59.3	0	0	0	112	V181 A184 Q189 D190 S191 M195 L196 L197 C226 V229 L230	V181-L193 HydrophobicContact CB-CD1 3.86Å; V181-L193 HydrophobicContact CG1-CD1 4Å; A184-L193 HydrophobicContact CB-CB 4.15Å; A184-L193 HydrophobicContact CB-CD1 4.07Å; Q189-L193 WeakPolarHBondContact O-CB 3.23Å; Q189-L193 PolarHBondContact O-N 2.75Å; D190-L193 WeakPolarHBondContact O-CB 3.49Å; D190-L193 PolarHBondContact O-N 2.78Å; D190-L193 VanDerWaalsContact O-N 3.17Å; S191-L193 VanDerWaalsContact C-N 3.3Å; L193-M195 PolarHBondContact O-N 3.26Å; L193-L196 PolarHBondContact O-N 2.79Å; L193-L197 HydrophobicContact CD1-CD1 4.28Å; L193-L197 HydrophobicContact CD1-CG 4.44Å; L193-L197 HydrophobicContact CG-CD1 4.03Å; L193-L197 WeakPolarHBondContact O-CB 3.23Å; L193-L197 VanDerWaalsContact O-CG 3.28Å; L193-L197 WeakPolarHBondContact O-CG 3.46Å; L193-L197 PolarHBondContact O-N 3.33Å; L193-C226 HydrophobicContact CD2-CB 3.79Å; L193-V229 HydrophobicContact CB-CG1 4.2Å; L193-V229 HydrophobicContact CD2-CB 4.38Å; L193-V229 HydrophobicContact CD2-CG1 4.07Å; L193-V229 HydrophobicContact CG-CG1 3.93Å; L193-L230 HydrophobicContact CD1-CD2 4.32Å; L193-L230 HydrophobicContact CD2-CD1 3.78Å; L193-L230 HydrophobicContact CD2-CD2 4.08Å; L193-L230 HydrophobicContact CD2-CG 3.67Å; L193-L230 HydrophobicContact CG-CD2 4.43Å; L193-L230 HydrophobicContact CG-CG 4.47Å
194	R	94.6	Very high	92.8	Very high	104 Å²	104	38.2 Å²	38.2	39%	0.392	22%	0.217	S	C	.	.	H	α-helix	trans	-54.6	-41.6	169.9	-70.9	-174.6	-172.4	-77.2	-1.8	111	D190 S198 V229 E232	D190-R194 WeakPolarHBondContact O-CG 3.44Å; D190-R194 PolarHBondContact O-N 3Å; R194-S198 WeakPolarHBondContact O-CB 3.46Å; R194-S198 PolarHBondContact O-N 3.12Å; R194-S198 PolarHBondContact O-OG 3.19Å; R194-V229 HydrophobicContact CG-CB 4.41Å; R194-V229 HydrophobicContact CG-CG1 3.69Å; R194-V229 HydrophobicContact CG-CG2 3.74Å; R194-E232 IonicContact CZ-OE2 2.85Å; R194-E232 VanDerWaalsContact CZ-OE2 3.31Å; R194-E232 IonicContact NH1-OE2 2.86Å; R194-E232 PolarHBondContact NH1-OE2 3.3Å; R194-E232 IonicContact NH2-OE2 3.26Å; R194-E232 PolarHBondContact NH2-OE2 3.3Å
195	M	93	Very high	92.9	Very high	22 Å²	22	40.7 Å²	40.7	11%	0.108	23%	0.231	C	C	.	.	H	α-helix	trans	-66.6	-47.6	177.9	-71.2	-48.5	-40.1	0	0	113.7	A156 R160 S191 C192 L193 L197 S198 A199	A156-M195 HydrophobicContact CB-CG 4.5Å; R160-M195 HydrophobicContact CB-CE 3.78Å; R160-M195 HydrophobicContact CB-CG 4.25Å; R160-M195 HydrophobicContact CB-SD 4.36Å; R160-M195 HydrophobicContact CG-CE 3.57Å; R160-M195 PolarHBondContact NE-SD 3.4Å; R160-M195 PolarHBondContact NH2-SD 2.96Å; S191-M195 WeakPolarHBondContact O-CG 3.48Å; S191-M195 PolarHBondContact O-N 3.06Å; C192-M195 WeakPolarHBondContact O-CB 3.25Å; C192-M195 PolarHBondContact O-N 3.21Å; L193-M195 PolarHBondContact O-N 3.26Å; M195-L197 VanDerWaalsContact C-N 3.35Å; M195-L197 PolarHBondContact O-N 2.87Å; M195-S198 WeakPolarHBondContact CE-OG 3.32Å; M195-S198 PolarHBondContact O-N 3.41Å; M195-S198 PolarHBondContact O-OG 3.32Å; M195-A199 PolarHBondContact O-N 3.27Å; M195-A199 VanDerWaalsContact O-N 3.13Å
196	L	91.8	Very high	92.8	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62.3	-41.7	179.5	-69.9	165.5	0	0	0	111.9	L147 I151 V159 L170 A180 V181 A184 C192 L193 A199 Q200	L147-L196 HydrophobicContact CD1-CD2 4.49Å; I151-L196 HydrophobicContact CD1-CD1 3.91Å; I151-L196 HydrophobicContact CG1-CD1 4.38Å; V159-L196 HydrophobicContact CG1-CD1 4.44Å; V159-L196 HydrophobicContact CG1-CD2 3.91Å; V159-L196 HydrophobicContact CG1-CG 3.89Å; L170-L196 HydrophobicContact CD2-CD2 4.01Å; A180-L196 HydrophobicContact CB-CD1 3.88Å; A180-L196 HydrophobicContact CB-CD2 3.81Å; A180-L196 HydrophobicContact CB-CG 4.49Å; V181-L196 HydrophobicContact CG1-CB 3.89Å; V181-L196 HydrophobicContact CG1-CD1 4.39Å; A184-L196 HydrophobicContact CB-CD1 4Å; C192-L196 WeakPolarHBondContact O-CG 3.47Å; C192-L196 PolarHBondContact O-N 3.26Å; L193-L196 PolarHBondContact O-N 2.79Å; L196-A199 PolarHBondContact O-N 3.12Å; L196-Q200 PolarHBondContact O-N 3.49Å
197	L	92.4	Very high	92.8	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.01	26%	0.255	C	S	.	.	H	α-helix	trans	-68.9	-35.3	177.9	-65.9	171.2	0	0	0	112.1	V181 L193 M195 A199 Q200 P201 V204 V229 L230 N233	V181-L197 HydrophobicContact CG1-CD2 4.07Å; V181-L197 HydrophobicContact CG1-CG 4.48Å; L193-L197 HydrophobicContact CD1-CD1 4.28Å; L193-L197 HydrophobicContact CD1-CG 4.44Å; L193-L197 HydrophobicContact CG-CD1 4.03Å; L193-L197 WeakPolarHBondContact O-CB 3.23Å; L193-L197 VanDerWaalsContact O-CG 3.28Å; L193-L197 WeakPolarHBondContact O-CG 3.46Å; L193-L197 PolarHBondContact O-N 3.33Å; M195-L197 VanDerWaalsContact C-N 3.35Å; M195-L197 PolarHBondContact O-N 2.87Å; L197-A199 VanDerWaalsContact C-N 3.28Å; L197-A199 PolarHBondContact O-N 3.4Å; L197-Q200 CarbonylContact O-C 3.46Å; L197-Q200 PolarHBondContact O-N 2.98Å; L197-P201 WeakPolarHBondContact O-CA 3.47Å; L197-P201 VanDerWaalsContact O-CD 3.31Å; L197-P201 WeakPolarHBondContact O-CD 3.4Å; L197-P201 WeakPolarHBondContact O-CG 3.42Å; L197-P201 VanDerWaalsContact O-N 3.15Å; L197-V204 HydrophobicContact CD2-CB 3.86Å; L197-V204 HydrophobicContact CD2-CG2 4.1Å; L197-V229 HydrophobicContact CD1-CG1 4Å; L197-L230 HydrophobicContact CD1-CD2 4.11Å; L197-N233 HydrophobicContact CD1-CB 3.83Å
198	S	91.2	Very high	92.9	Very high	74 Å²	74	42.9 Å²	42.9	52%	0.517	24%	0.24	S	C	.	.	H	α-helix	trans	-66.7	-27.9	173.1	74	0	0	0	0	113.7	R194 M195	R194-S198 WeakPolarHBondContact O-CB 3.46Å; R194-S198 PolarHBondContact O-N 3.12Å; R194-S198 PolarHBondContact O-OG 3.19Å; M195-S198 WeakPolarHBondContact CE-OG 3.32Å; M195-S198 PolarHBondContact O-N 3.41Å; M195-S198 PolarHBondContact O-OG 3.32Å
199	A	89.9	Confident	92.7	Very high	32 Å²	32	45.5 Å²	45.5	26%	0.264	26%	0.255	S	S	.	.	H	α-helix	trans	-82.3	-37.9	176.4	0	0	0	0	0	112.5	A163 M164 L170 M195 L196 L197	A163-A199 HydrophobicContact CB-CB 4.21Å; M164-A199 HydrophobicContact CE-CB 3.99Å; L170-A199 HydrophobicContact CD1-CB 4.04Å; M195-A199 PolarHBondContact O-N 3.27Å; M195-A199 VanDerWaalsContact O-N 3.13Å; L196-A199 PolarHBondContact O-N 3.12Å; L197-A199 VanDerWaalsContact C-N 3.28Å; L197-A199 PolarHBondContact O-N 3.4Å
200	Q	89.5	Confident	92.5	Very high	79 Å²	79	51.4 Å²	51.4	37%	0.369	28%	0.276	S	S	.	.			trans	-148.4	87.4	-179.6	-177.6	67.6	-21.3	0	0	111.9	L170 M171 L196 L197 G202 M203	L170-Q200 HydrophobicContact CD1-CB 4.11Å; M171-Q200 HydrophobicContact SD-CG 3.96Å; L196-Q200 PolarHBondContact O-N 3.49Å; L197-Q200 CarbonylContact O-C 3.46Å; L197-Q200 PolarHBondContact O-N 2.98Å; Q200-G202 PolarHBondContact O-N 3.23Å; Q200-M203 HydrophobicContact CB-CG 4.23Å; Q200-M203 HydrophobicContact CB-SD 3.76Å; Q200-M203 HydrophobicContact CG-CG 3.71Å; Q200-M203 HydrophobicContact CG-SD 3.79Å; Q200-M203 PolarHBondContact O-N 2.82Å
201	P	89.5	Confident	92.5	Very high	86 Å²	86	48.9 Å²	48.9	56%	0.558	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-59.4	-32.2	-177.7	-25.8	33.6	0	0	0	114	L197 M203 V204	L197-P201 WeakPolarHBondContact O-CA 3.47Å; L197-P201 VanDerWaalsContact O-CD 3.31Å; L197-P201 WeakPolarHBondContact O-CD 3.4Å; L197-P201 WeakPolarHBondContact O-CG 3.42Å; L197-P201 VanDerWaalsContact O-N 3.15Å; P201-M203 PolarHBondContact O-N 3.46Å; P201-V204 WeakPolarHBondContact O-CG1 3.46Å; P201-V204 PolarHBondContact O-N 3.39Å; P201-V204 VanDerWaalsContact O-N 3.1Å
202	G	89.1	Confident	92.5	Very high	45 Å²	45	47.3 Å²	47.3	46%	0.464	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-63.6	-1.1	-178.2	0	0	0	0	0	116	Q200 K206	Q200-G202 PolarHBondContact O-N 3.23Å; G202-K206 WeakPolarHBondContact O-CE 3.37Å; G202-K206 WeakPolarHBondContact O-CG 3.48Å
203	M	92.7	Very high	92.7	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-82.4	-21.4	173.3	-66.5	171.9	78.1	0	0	113.6	L170 M171 L179 A180 V181 Q200 P201 N205 K206	L170-M203 HydrophobicContact CB-CE 3.96Å; L170-M203 HydrophobicContact CB-SD 3.7Å; L170-M203 HydrophobicContact CD1-SD 4.41Å; L170-M203 WeakPolarHBondContact O-CE 3.37Å; M171-M203 HydrophobicContact SD-CG 3.46Å; M171-M203 WeakPolarHBondContact SD-CG 3.48Å; M171-M203 HydrophobicContact SD-SD 4.35Å; L179-M203 HydrophobicContact CB-CE 3.77Å; L179-M203 HydrophobicContact CD1-CE 4.15Å; L179-M203 HydrophobicContact CD1-CG 4.41Å; L179-M203 HydrophobicContact CG-CE 4.48Å; A180-M203 HydrophobicContact CB-CE 4.3Å; V181-M203 HydrophobicContact CB-CE 4.48Å; V181-M203 HydrophobicContact CG1-CB 3.95Å; V181-M203 HydrophobicContact CG1-CE 3.91Å; V181-M203 HydrophobicContact CG1-SD 4.28Å; V181-M203 HydrophobicContact CG2-CB 3.92Å; V181-M203 HydrophobicContact CG2-CE 4.05Å; Q200-M203 HydrophobicContact CB-CG 4.23Å; Q200-M203 HydrophobicContact CB-SD 3.76Å; Q200-M203 HydrophobicContact CG-CG 3.71Å; Q200-M203 HydrophobicContact CG-SD 3.79Å; Q200-M203 PolarHBondContact O-N 2.82Å; P201-M203 PolarHBondContact O-N 3.46Å; M203-N205 VanDerWaalsContact C-N 3.26Å; M203-N205 PolarHBondContact O-N 3.25Å; M203-N205 VanDerWaalsContact O-N 3.12Å; M203-K206 WeakPolarHBondContact O-CB 3.39Å; M203-K206 PolarHBondContact O-N 3.25Å
204	V	94.4	Very high	92.7	Very high	13 Å²	13	47.3 Å²	47.3	8%	0.079	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-33.7	-165.9	72.8	0	0	0	0	114.5	L197 P201 P214 L230 A235	L197-V204 HydrophobicContact CD2-CB 3.86Å; L197-V204 HydrophobicContact CD2-CG2 4.1Å; P201-V204 WeakPolarHBondContact O-CG1 3.46Å; P201-V204 PolarHBondContact O-N 3.39Å; P201-V204 VanDerWaalsContact O-N 3.1Å; V204-P214 VanDerWaalsContact O-CD 3.3Å; V204-P214 WeakPolarHBondContact O-CD 3.37Å; V204-L230 HydrophobicContact CG2-CD2 4.01Å; V204-A235 HydrophobicContact CG2-CB 3.72Å
205	N	95.6	Very high	92.9	Very high	53 Å²	53	42.4 Å²	42.4	28%	0.283	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.6	15.8	-179.4	-68	-33.7	0	0	0	113.5	M203 G234 A235 D236 I239	M203-N205 VanDerWaalsContact C-N 3.26Å; M203-N205 PolarHBondContact O-N 3.25Å; M203-N205 VanDerWaalsContact O-N 3.12Å; N205-G234 PolarHBondContact ND2-O 3.23Å; N205-A235 WeakPolarHBondContact OD1-CA 3.01Å; N205-D236 PolarHBondContact OD1-N 2.95Å; N205-I239 HydrophobicContact CB-CD1 3.88Å
206	K	94	Very high	93.1	Very high	99 Å²	99	41.3 Å²	41.3	43%	0.43	22%	0.224	S	C	.	.			trans	-69.6	156.2	173	-65.1	-70.5	165	179.5	0	110	M171 L179 H182 G202 M203 P214	M171-K206 HydrophobicContact CE-CD 4Å; M171-K206 HydrophobicContact CE-CG 4.07Å; L179-K206 HydrophobicContact CD1-CB 3.61Å; L179-K206 HydrophobicContact CD1-CG 3.94Å; H182-K206 PolarHBondContact NE2-O 2.91Å; G202-K206 WeakPolarHBondContact O-CE 3.37Å; G202-K206 WeakPolarHBondContact O-CG 3.48Å; M203-K206 WeakPolarHBondContact O-CB 3.39Å; M203-K206 PolarHBondContact O-N 3.25Å; K206-P214 WeakPolarHBondContact O-CD 3.48Å
207	R	93.9	Very high	93.2	Very high	106 Å²	106	41.5 Å²	41.5	40%	0.4	23%	0.225	S	C	.	.			trans	-119.8	139.7	-170.4	-62.5	174.8	78.5	-165.5	5.7	111.5	G211 E212 T213 P240	R207-G211 PolarHBondContact NE-O 2.89Å; R207-G211 PolarHBondContact NH2-O 3.26Å; R207-E212 CarbonylContact C-O 3.48Å; R207-E212 VanDerWaalsContact CA-O 3.26Å; R207-E212 WeakPolarHBondContact CA-O 3.42Å; R207-T213 HydrophobicContact CG-CG2 4.19Å; R207-P240 PolarHBondContact NH2-O 3.4Å
208	T	93.2	Very high	93.5	Very high	4 Å²	4	41.4 Å²	41.4	3%	0.025	23%	0.225	C	C	.	.			trans	-67.3	175.2	171.7	70.4	0	0	0	0	111.7	G177 W178 H182 R210 G211 E212	G177-T208 WeakPolarHBondContact O-CA 3.46Å; W178-T208 HydrophobicContact CG-CG2 4.25Å; H182-T208 WeakPolarHBondContact CD2-CG2 3.29Å; T208-R210 PolarHBondContact O-N 3.26Å; T208-R210 PolarHBondContact OG1-N 3.35Å; T208-R210 VanDerWaalsContact OG1-N 3.13Å; T208-G211 PolarHBondContact O-N 3.42Å; T208-E212 HydrophobicContact CG2-CB 4.23Å; T208-E212 PolarHBondContact N-O 3.38Å; T208-E212 WeakPolarHBondContact OG1-CB 3.39Å; T208-E212 PolarHBondContact OG1-N 3.21Å; T208-E212 PolarHBondContact OG1-OE2 3.46Å
209	S	91	Very high	93.8	Very high	76 Å²	76	37.9 Å²	37.9	53%	0.531	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-3.8	170	-60	0	0	0	0	114.2	P176 G177 Y242	P176-S209 VanDerWaalsContact C-OG 3.27Å; P176-S209 VanDerWaalsContact O-CB 3.26Å; P176-S209 WeakPolarHBondContact O-CB 3.23Å; P176-S209 PolarHBondContact O-N 3.08Å; P176-S209 VanDerWaalsContact O-N 3.12Å; P176-S209 PolarHBondContact O-OG 2.71Å; G177-S209 WeakPolarHBondContact CA-OG 3.27Å; G177-S209 PolarHBondContact N-OG 2.79Å; S209-Y242 WeakPolarHBondContact O-CE2 3.36Å
210	R	89.9	Confident	94	Very high	171 Å²	171	37.2 Å²	37.2	65%	0.645	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102	2.5	170	-62.7	-178.7	177	-167.4	-3.4	113.3	T208 E212 Y242	T208-R210 PolarHBondContact O-N 3.26Å; T208-R210 PolarHBondContact OG1-N 3.35Å; T208-R210 VanDerWaalsContact OG1-N 3.13Å; R210-E212 VanDerWaalsContact C-N 3.3Å; R210-E212 HydrophobicContact CB-CG 3.93Å; R210-Y242 WeakPolarHBondContact O-CD2 3.44Å; R210-Y242 PolarHBondContact O-N 3.31Å; R210-Y242 VanDerWaalsContact O-N 3.13Å
211	G	93.7	Very high	94.3	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.197	C	C	.	.	S	Bend	trans	79.1	8	-174.8	0	0	0	0	0	114.2	R207 T208	R207-G211 PolarHBondContact NE-O 2.89Å; R207-G211 PolarHBondContact NH2-O 3.26Å; T208-G211 PolarHBondContact O-N 3.42Å
212	E	95.1	Very high	94.6	Very high	28 Å²	28	38.1 Å²	38.1	13%	0.131	19%	0.19	C	C	.	.			trans	-79.8	136.2	-176.1	-55.2	156.1	139.8	0	0	110.8	H182 R207 T208 R210 L216 V217 N241	H182-E212 PolarHBondContact NE2-O 2.68Å; R207-E212 CarbonylContact C-O 3.48Å; R207-E212 VanDerWaalsContact CA-O 3.26Å; R207-E212 WeakPolarHBondContact CA-O 3.42Å; T208-E212 HydrophobicContact CG2-CB 4.23Å; T208-E212 PolarHBondContact N-O 3.38Å; T208-E212 WeakPolarHBondContact OG1-CB 3.39Å; T208-E212 PolarHBondContact OG1-N 3.21Å; T208-E212 PolarHBondContact OG1-OE2 3.46Å; R210-E212 VanDerWaalsContact C-N 3.3Å; R210-E212 HydrophobicContact CB-CG 3.93Å; E212-L216 HydrophobicContact CB-CB 4.46Å; E212-L216 HydrophobicContact CB-CD2 4.14Å; E212-L216 HydrophobicContact CG-CD2 4.12Å; E212-V217 HydrophobicContact CB-CG2 4.02Å; E212-N241 HydrophobicContact CG-CB 4.05Å
213	T	96.9	Very high	95	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.18	C	C	.	.			trans	-82.8	163.7	168.8	57.6	0	0	0	0	111.2	R207 L215 L216 V217 I239	R207-T213 HydrophobicContact CG-CG2 4.19Å; T213-L215 PolarHBondContact O-N 3.05Å; T213-L216 PolarHBondContact O-N 2.8Å; T213-L216 PolarHBondContact OG1-N 3.17Å; T213-V217 WeakPolarHBondContact O-CG2 3.32Å; T213-V217 PolarHBondContact O-N 3.06Å; T213-I239 HydrophobicContact CG2-CB 3.83Å; T213-I239 HydrophobicContact CG2-CD1 4.2Å; T213-I239 HydrophobicContact CG2-CG2 3.59Å
214	P	96.3	Very high	95	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-54.4	-35.7	171	-25	34.3	0	0	0	112.3	V181 H182 A185 V204 K206 V217 A218 L230	V181-P214 HydrophobicContact CB-CB 4.41Å; V181-P214 HydrophobicContact CB-CG 4.18Å; V181-P214 HydrophobicContact CG2-CB 4.26Å; V181-P214 HydrophobicContact CG2-CG 3.53Å; H182-P214 WeakPolarHBondContact NE2-CD 3.49Å; A185-P214 HydrophobicContact CB-CB 4.31Å; A185-P214 VanDerWaalsContact CB-O 3.3Å; A185-P214 WeakPolarHBondContact CB-O 3.42Å; V204-P214 VanDerWaalsContact O-CD 3.3Å; V204-P214 WeakPolarHBondContact O-CD 3.37Å; K206-P214 WeakPolarHBondContact O-CD 3.48Å; P214-V217 PolarHBondContact O-N 3.04Å; P214-A218 WeakPolarHBondContact O-CB 3.5Å; P214-A218 PolarHBondContact O-N 3.16Å; P214-L230 HydrophobicContact CB-CD1 4.22Å; P214-L230 HydrophobicContact CB-CD2 3.86Å
215	L	97.6	Very high	95.1	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62	-49.7	173.4	-179.9	62.1	0	0	0	111.9	T213 V217 A218 V219 V227 L230 L231 A235 P237 P247 L263	T213-L215 PolarHBondContact O-N 3.05Å; L215-V217 VanDerWaalsContact C-N 3.27Å; L215-V217 PolarHBondContact O-N 3.12Å; L215-A218 PolarHBondContact O-N 3.28Å; L215-V219 HydrophobicContact CD1-CG2 4.3Å; L215-V219 VanDerWaalsContact O-CG2 3.29Å; L215-V219 WeakPolarHBondContact O-CG2 3.32Å; L215-V219 PolarHBondContact O-N 3.08Å; L215-V227 HydrophobicContact CD1-CB 4.41Å; L215-V227 HydrophobicContact CD1-CG1 4.01Å; L215-V227 HydrophobicContact CD1-CG2 4.38Å; L215-L230 HydrophobicContact CB-CD1 4.41Å; L215-L230 HydrophobicContact CD1-CB 4.18Å; L215-L231 HydrophobicContact CD1-CD2 4.28Å; L215-L231 HydrophobicContact CD1-CG 4.21Å; L215-L231 HydrophobicContact CD2-CD2 3.86Å; L215-A235 HydrophobicContact CB-CB 4.13Å; L215-A235 HydrophobicContact CD2-CB 3.99Å; L215-P237 HydrophobicContact CD2-CB 3.98Å; L215-P247 HydrophobicContact CD2-CB 4.35Å; L215-P247 HydrophobicContact CD2-CG 4.16Å; L215-P247 HydrophobicContact CG-CB 4.35Å; L215-P247 HydrophobicContact CG-CG 4.28Å; L215-L263 HydrophobicContact CD2-CD2 4.35Å
216	L	96.6	Very high	95.1	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-63.1	-34.4	177.9	-169	62.9	0	0	0	112.4	E212 T213 S220 N241 P247 K250	E212-L216 HydrophobicContact CB-CB 4.46Å; E212-L216 HydrophobicContact CB-CD2 4.14Å; E212-L216 HydrophobicContact CG-CD2 4.12Å; T213-L216 PolarHBondContact O-N 2.8Å; T213-L216 PolarHBondContact OG1-N 3.17Å; L216-S220 VanDerWaalsContact O-CB 3.27Å; L216-S220 WeakPolarHBondContact O-CB 3.44Å; L216-S220 PolarHBondContact O-N 3.09Å; L216-S220 PolarHBondContact O-OG 2.97Å; L216-N241 HydrophobicContact CD2-CB 3.64Å; L216-P247 HydrophobicContact CB-CG 4.45Å; L216-P247 HydrophobicContact CD1-CB 4.43Å; L216-P247 HydrophobicContact CD1-CG 4.12Å; L216-K250 HydrophobicContact CD1-CB 3.94Å; L216-K250 HydrophobicContact CD1-CG 3.8Å
217	V	95.8	Very high	95.2	Very high	3 Å²	3	38.4 Å²	38.4	2%	0.018	19%	0.189	C	C	.	.	H	α-helix	trans	-66.1	-46.9	173.4	174.1	0	0	0	0	111.5	W178 A185 W186 E212 T213 P214 L215 S220 R221	W178-V217 HydrophobicContact CH2-CG1 4.44Å; A185-V217 HydrophobicContact CB-CB 4.41Å; A185-V217 HydrophobicContact CB-CG1 4.23Å; W186-V217 HydrophobicContact CB-CG1 3.81Å; W186-V217 HydrophobicContact CE3-CG1 4.03Å; E212-V217 HydrophobicContact CB-CG2 4.02Å; T213-V217 WeakPolarHBondContact O-CG2 3.32Å; T213-V217 PolarHBondContact O-N 3.06Å; P214-V217 PolarHBondContact O-N 3.04Å; L215-V217 VanDerWaalsContact C-N 3.27Å; L215-V217 PolarHBondContact O-N 3.12Å; V217-S220 PolarHBondContact O-N 2.64Å; V217-R221 PolarHBondContact O-N 3.09Å; V217-R221 VanDerWaalsContact O-N 3.15Å
218	A	97.2	Very high	95.3	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.3	-45.3	176.2	0	0	0	0	0	111.7	A185 P214 L215 R221 V222 Q223 C226 V227 L230	A185-A218 HydrophobicContact CB-CB 4.05Å; P214-A218 WeakPolarHBondContact O-CB 3.5Å; P214-A218 PolarHBondContact O-N 3.16Å; L215-A218 PolarHBondContact O-N 3.28Å; A218-R221 CarbonylContact O-C 3.6Å; A218-R221 PolarHBondContact O-N 2.98Å; A218-V222 PolarHBondContact O-N 3.29Å; A218-Q223 HydrophobicContact CB-CB 4.38Å; A218-Q223 PolarHBondContact O-N 3.03Å; A218-C226 HydrophobicContact CB-CB 3.85Å; A218-V227 HydrophobicContact CB-CG2 3.85Å; A218-L230 HydrophobicContact CB-CD1 3.91Å
219	V	97.4	Very high	95.5	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-61.6	-46.6	176.2	171.4	0	0	0	0	111.4	L215 R221 V222 V227 P247 K250 A251 I259 L263	L215-V219 HydrophobicContact CD1-CG2 4.3Å; L215-V219 VanDerWaalsContact O-CG2 3.29Å; L215-V219 WeakPolarHBondContact O-CG2 3.32Å; L215-V219 PolarHBondContact O-N 3.08Å; V219-R221 PolarHBondContact O-N 2.92Å; V219-R221 VanDerWaalsContact O-N 3.14Å; V219-V222 PolarHBondContact O-N 3.34Å; V219-V227 HydrophobicContact CG2-CG2 3.74Å; V219-P247 WeakPolarHBondContact CG1-O 3.41Å; V219-P247 HydrophobicContact CG2-CB 4.38Å; V219-K250 HydrophobicContact CG1-CB 3.98Å; V219-A251 HydrophobicContact CG1-CB 3.78Å; V219-A251 VanDerWaalsContact CG1-N 3.32Å; V219-I259 HydrophobicContact CB-CG2 4.46Å; V219-I259 HydrophobicContact CG1-CG2 4.12Å; V219-I259 HydrophobicContact CG2-CG2 3.82Å; V219-L263 HydrophobicContact CG2-CD1 4.34Å
220	S	95.5	Very high	95.8	Very high	18 Å²	18	33.4 Å²	33.4	13%	0.126	16%	0.161	C	C	.	.	H	α-helix	trans	-62.9	-21.6	179.5	-61	0	0	0	0	113.2	L216 V217 R254	L216-S220 VanDerWaalsContact O-CB 3.27Å; L216-S220 WeakPolarHBondContact O-CB 3.44Å; L216-S220 PolarHBondContact O-N 3.09Å; L216-S220 PolarHBondContact O-OG 2.97Å; V217-S220 PolarHBondContact O-N 2.64Å; S220-R254 WeakPolarHBondContact O-CD 3.46Å; S220-R254 PolarHBondContact O-NH1 3.13Å
221	R	95.6	Very high	96	Very high	119 Å²	119	25.7 Å²	25.7	45%	0.449	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	5.3	173.5	-66.9	-50.6	-164.3	120.9	-21.9	114.4	W186 V217 A218 V219 Q223	W186-R221 HydrophobicContact CD2-CG 3.93Å; W186-R221 VanDerWaalsContact CE2-CZ 3.5Å; W186-R221 HydrophobicContact CE3-CG 3.51Å; W186-R221 HydrophobicContact CG-CG 4.41Å; W186-R221 VanDerWaalsContact CZ2-CZ 3.49Å; W186-R221 HydrophobicContact CZ3-CG 4.25Å; V217-R221 PolarHBondContact O-N 3.09Å; V217-R221 VanDerWaalsContact O-N 3.15Å; A218-R221 CarbonylContact O-C 3.6Å; A218-R221 PolarHBondContact O-N 2.98Å; V219-R221 PolarHBondContact O-N 2.92Å; V219-R221 VanDerWaalsContact O-N 3.14Å; R221-Q223 HydrophobicContact CB-CG 3.67Å; R221-Q223 PolarHBondContact O-N 3.49Å
222	V	96.3	Very high	96.1	Very high	66 Å²	66	30.3 Å²	30.3	40%	0.4	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	30.7	179.1	-156.1	0	0	0	0	112.9	A218 V219 Q224 R254 I259	A218-V222 PolarHBondContact O-N 3.29Å; V219-V222 PolarHBondContact O-N 3.34Å; V222-Q224 PolarHBondContact O-N 3.28Å; V222-R254 HydrophobicContact CG2-CB 3.87Å; V222-R254 HydrophobicContact CG2-CG 4.23Å; V222-I259 HydrophobicContact CB-CD1 4.39Å; V222-I259 HydrophobicContact CG1-CD1 3.87Å
223	Q	95.7	Very high	96.1	Very high	57 Å²	57	32.3 Å²	32.3	27%	0.266	17%	0.166	S	C	.	.			trans	-84.9	75.3	-174.8	-58.8	-68.1	9.5	0	0	111	A185 W186 A218 R221 G225 C226 V227	A185-Q223 WeakPolarHBondContact O-CG 3.39Å; W186-Q223 PolarHBondContact O-NE2 3.42Å; A218-Q223 HydrophobicContact CB-CB 4.38Å; A218-Q223 PolarHBondContact O-N 3.03Å; R221-Q223 HydrophobicContact CB-CG 3.67Å; R221-Q223 PolarHBondContact O-N 3.49Å; Q223-G225 VanDerWaalsContact C-N 3.3Å; Q223-G225 PolarHBondContact O-N 3.27Å; Q223-C226 HydrophobicContact CB-CB 3.97Å; Q223-C226 WeakPolarHBondContact O-CB 3.29Å; Q223-C226 PolarHBondContact O-N 3.07Å; Q223-V227 PolarHBondContact O-N 2.89Å
224	Q	94.4	Very high	95.9	Very high	117 Å²	117	34.7 Å²	34.7	55%	0.547	19%	0.19	S	C	.	.	H	α-helix	trans	-52.7	-41.9	-172.9	-174.6	179.7	-11.6	0	0	113.6	V222 V227 Q228 I259	V222-Q224 PolarHBondContact O-N 3.28Å; Q224-V227 PolarHBondContact O-N 3.25Å; Q224-Q228 PolarHBondContact O-N 3.49Å; Q224-I259 HydrophobicContact CB-CG1 4.45Å
225	G	94.9	Very high	95.9	Very high	40 Å²	40	35 Å²	35	41%	0.412	19%	0.193	S	C	.	.	H	α-helix	trans	-61.5	-44.8	176.2	0	0	0	0	0	112.8	Q223 Q228 V229	Q223-G225 VanDerWaalsContact C-N 3.3Å; Q223-G225 PolarHBondContact O-N 3.27Å; G225-Q228 PolarHBondContact O-N 2.86Å; G225-V229 WeakPolarHBondContact O-CG2 3.26Å; G225-V229 PolarHBondContact O-N 2.8Å
226	C	96.2	Very high	95.8	Very high	1 Å²	1	38 Å²	38	1%	0.007	21%	0.209	C	C	.	.	H	α-helix	trans	-65.2	-39.4	175.2	-67.9	0	0	0	0	112.5	Q189 L193 A218 Q223 V229 L230	Q189-C226 PolarHBondContact N-SG 3Å; L193-C226 HydrophobicContact CD2-CB 3.79Å; A218-C226 HydrophobicContact CB-CB 3.85Å; Q223-C226 HydrophobicContact CB-CB 3.97Å; Q223-C226 WeakPolarHBondContact O-CB 3.29Å; Q223-C226 PolarHBondContact O-N 3.07Å; C226-V229 PolarHBondContact O-N 3.23Å; C226-L230 WeakPolarHBondContact O-CB 3.49Å; C226-L230 VanDerWaalsContact O-CD1 3.23Å; C226-L230 WeakPolarHBondContact O-CD1 3.33Å; C226-L230 WeakPolarHBondContact O-CG 3.18Å; C226-L230 PolarHBondContact O-N 3.1Å
227	V	97.1	Very high	95.7	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.006	22%	0.215	C	C	.	.	H	α-helix	trans	-58	-48.9	175.2	170.1	0	0	0	0	110.5	L215 A218 V219 Q223 Q224 L230 L231 I259	L215-V227 HydrophobicContact CD1-CB 4.41Å; L215-V227 HydrophobicContact CD1-CG1 4.01Å; L215-V227 HydrophobicContact CD1-CG2 4.38Å; A218-V227 HydrophobicContact CB-CG2 3.85Å; V219-V227 HydrophobicContact CG2-CG2 3.74Å; Q223-V227 PolarHBondContact O-N 2.89Å; Q224-V227 PolarHBondContact O-N 3.25Å; V227-L230 PolarHBondContact O-N 3.19Å; V227-L231 HydrophobicContact CG1-CD1 3.82Å; V227-L231 HydrophobicContact CG1-CG 4.46Å; V227-L231 WeakPolarHBondContact O-CG 3.42Å; V227-L231 PolarHBondContact O-N 3.14Å; V227-I259 HydrophobicContact CG1-CG2 4.34Å; V227-I259 HydrophobicContact CG2-CD1 4.24Å; V227-I259 HydrophobicContact CG2-CG1 4.48Å; V227-I259 HydrophobicContact CG2-CG2 4.38Å
228	Q	96.2	Very high	95.7	Very high	81 Å²	81	41.8 Å²	41.8	38%	0.379	23%	0.228	S	C	.	.	H	α-helix	trans	-60.9	-47.4	178.4	-176.2	60.5	29.1	0	0	111.7	Q224 G225 L230 L231 E232	Q224-Q228 PolarHBondContact O-N 3.49Å; G225-Q228 PolarHBondContact O-N 2.86Å; Q228-L230 VanDerWaalsContact C-N 3.3Å; Q228-L230 PolarHBondContact O-N 3.29Å; Q228-L231 PolarHBondContact O-N 2.97Å; Q228-E232 VanDerWaalsContact CG-OE1 3.31Å; Q228-E232 WeakPolarHBondContact CG-OE1 3.35Å; Q228-E232 PolarHBondContact NE2-OE1 3.26Å; Q228-E232 WeakPolarHBondContact O-CB 3.42Å; Q228-E232 VanDerWaalsContact O-CG 3.27Å; Q228-E232 WeakPolarHBondContact O-CG 3.18Å; Q228-E232 PolarHBondContact O-N 3.04Å
229	V	96.3	Very high	95.6	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-55.6	-44.4	175.1	169.1	0	0	0	0	111.9	D190 L193 R194 L197 G225 C226 N233	D190-V229 HydrophobicContact CB-CG2 4Å; L193-V229 HydrophobicContact CB-CG1 4.2Å; L193-V229 HydrophobicContact CD2-CB 4.38Å; L193-V229 HydrophobicContact CD2-CG1 4.07Å; L193-V229 HydrophobicContact CG-CG1 3.93Å; R194-V229 HydrophobicContact CG-CB 4.41Å; R194-V229 HydrophobicContact CG-CG1 3.69Å; R194-V229 HydrophobicContact CG-CG2 3.74Å; L197-V229 HydrophobicContact CD1-CG1 4Å; G225-V229 WeakPolarHBondContact O-CG2 3.26Å; G225-V229 PolarHBondContact O-N 2.8Å; C226-V229 PolarHBondContact O-N 3.23Å; V229-N233 WeakPolarHBondContact O-CB 3.26Å; V229-N233 PolarHBondContact O-N 3.11Å; V229-N233 VanDerWaalsContact O-N 3.16Å; V229-N233 PolarHBondContact O-ND2 3.38Å
230	L	96.6	Very high	95.5	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-68.1	-45.3	-176.6	-76	158.7	0	0	0	111.5	A185 L193 L197 V204 P214 L215 A218 C226 V227 Q228 N233 G234 A235	A185-L230 HydrophobicContact CB-CD1 4.4Å; L193-L230 HydrophobicContact CD1-CD2 4.32Å; L193-L230 HydrophobicContact CD2-CD1 3.78Å; L193-L230 HydrophobicContact CD2-CD2 4.08Å; L193-L230 HydrophobicContact CD2-CG 3.67Å; L193-L230 HydrophobicContact CG-CD2 4.43Å; L193-L230 HydrophobicContact CG-CG 4.47Å; L197-L230 HydrophobicContact CD1-CD2 4.11Å; V204-L230 HydrophobicContact CG2-CD2 4.01Å; P214-L230 HydrophobicContact CB-CD1 4.22Å; P214-L230 HydrophobicContact CB-CD2 3.86Å; L215-L230 HydrophobicContact CB-CD1 4.41Å; L215-L230 HydrophobicContact CD1-CB 4.18Å; A218-L230 HydrophobicContact CB-CD1 3.91Å; C226-L230 WeakPolarHBondContact O-CB 3.49Å; C226-L230 VanDerWaalsContact O-CD1 3.23Å; C226-L230 WeakPolarHBondContact O-CD1 3.33Å; C226-L230 WeakPolarHBondContact O-CG 3.18Å; C226-L230 PolarHBondContact O-N 3.1Å; V227-L230 PolarHBondContact O-N 3.19Å; Q228-L230 VanDerWaalsContact C-N 3.3Å; Q228-L230 PolarHBondContact O-N 3.29Å; L230-N233 CarbonylContact O-C 3.44Å; L230-N233 PolarHBondContact O-N 3Å; L230-N233 VanDerWaalsContact O-N 3.14Å; L230-G234 PolarHBondContact O-N 2.98Å; L230-A235 VanDerWaalsContact C-CB 3.48Å; L230-A235 HydrophobicContact CB-CB 3.83Å; L230-A235 WeakPolarHBondContact O-CB 3.33Å; L230-A235 PolarHBondContact O-N 2.84Å
231	L	95.8	Very high	95.5	Very high	8 Å²	8	45.1 Å²	45.1	4%	0.042	25%	0.246	C	C	.	.	H	α-helix	trans	-63.8	-41.4	176.8	-67.2	171.9	0	0	0	111.8	L215 V227 Q228 N233 G234 P237 A262 L263	L215-L231 HydrophobicContact CD1-CD2 4.28Å; L215-L231 HydrophobicContact CD1-CG 4.21Å; L215-L231 HydrophobicContact CD2-CD2 3.86Å; V227-L231 HydrophobicContact CG1-CD1 3.82Å; V227-L231 HydrophobicContact CG1-CG 4.46Å; V227-L231 WeakPolarHBondContact O-CG 3.42Å; V227-L231 PolarHBondContact O-N 3.14Å; Q228-L231 PolarHBondContact O-N 2.97Å; L231-N233 PolarHBondContact O-N 3.5Å; L231-G234 PolarHBondContact O-N 3.03Å; L231-P237 HydrophobicContact CD2-CB 4.25Å; L231-A262 HydrophobicContact CD1-CB 4.36Å; L231-L263 HydrophobicContact CD1-CD2 4.26Å; L231-L263 HydrophobicContact CD2-CD2 4.25Å
232	E	94.4	Very high	95.4	Very high	97 Å²	97	46.2 Å²	46.2	45%	0.453	25%	0.252	S	S	.	.	H	α-helix	trans	-58.7	-30	172.6	-76.5	169.4	-173	0	0	113.2	R194 Q228	R194-E232 IonicContact CZ-OE2 2.85Å; R194-E232 VanDerWaalsContact CZ-OE2 3.31Å; R194-E232 IonicContact NH1-OE2 2.86Å; R194-E232 PolarHBondContact NH1-OE2 3.3Å; R194-E232 IonicContact NH2-OE2 3.26Å; R194-E232 PolarHBondContact NH2-OE2 3.3Å; Q228-E232 VanDerWaalsContact CG-OE1 3.31Å; Q228-E232 WeakPolarHBondContact CG-OE1 3.35Å; Q228-E232 PolarHBondContact NE2-OE1 3.26Å; Q228-E232 WeakPolarHBondContact O-CB 3.42Å; Q228-E232 VanDerWaalsContact O-CG 3.27Å; Q228-E232 WeakPolarHBondContact O-CG 3.18Å; Q228-E232 PolarHBondContact O-N 3.04Å
233	N	94.6	Very high	95.3	Very high	70 Å²	70	48.4 Å²	48.4	37%	0.374	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	19.1	-177.7	-74.6	-98	0	0	0	113.2	L197 V229 L230 L231	L197-N233 HydrophobicContact CD1-CB 3.83Å; V229-N233 WeakPolarHBondContact O-CB 3.26Å; V229-N233 PolarHBondContact O-N 3.11Å; V229-N233 VanDerWaalsContact O-N 3.16Å; V229-N233 PolarHBondContact O-ND2 3.38Å; L230-N233 CarbonylContact O-C 3.44Å; L230-N233 PolarHBondContact O-N 3Å; L230-N233 VanDerWaalsContact O-N 3.14Å; L231-N233 PolarHBondContact O-N 3.5Å
234	G	93.4	Very high	95.3	Very high	50 Å²	50	51.7 Å²	51.7	52%	0.515	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.6	27.7	173.5	0	0	0	0	0	115	N205 L230 L231 D236	N205-G234 PolarHBondContact ND2-O 3.23Å; L230-G234 PolarHBondContact O-N 2.98Å; L231-G234 PolarHBondContact O-N 3.03Å; G234-D236 PolarHBondContact O-N 3.12Å
235	A	96	Very high	95.3	Very high	7 Å²	7	46.8 Å²	46.8	6%	0.058	25%	0.248	C	C	.	.			trans	-61.9	131.9	165.4	0	0	0	0	0	110.3	V204 N205 L215 L230 P237	V204-A235 HydrophobicContact CG2-CB 3.72Å; N205-A235 WeakPolarHBondContact OD1-CA 3.01Å; L215-A235 HydrophobicContact CB-CB 4.13Å; L215-A235 HydrophobicContact CD2-CB 3.99Å; L230-A235 VanDerWaalsContact C-CB 3.48Å; L230-A235 HydrophobicContact CB-CB 3.83Å; L230-A235 WeakPolarHBondContact O-CB 3.33Å; L230-A235 PolarHBondContact O-N 2.84Å; A235-P237 WeakPolarHBondContact O-CD 3.42Å
236	D	95.3	Very high	95.4	Very high	64 Å²	64	45.2 Å²	45.2	34%	0.342	23%	0.23	S	C	.	.			trans	-83.9	113.7	177.5	180	-8.5	0	0	0	109.4	N205 G234 E238 I239	N205-D236 PolarHBondContact OD1-N 2.95Å; G234-D236 PolarHBondContact O-N 3.12Å; D236-E238 VanDerWaalsContact C-N 3.26Å; D236-E238 PolarHBondContact O-N 3.26Å; D236-E238 WeakPolarHBondContact OD1-CB 3.35Å; D236-E238 PolarHBondContact OD1-N 3.25Å; D236-I239 HydrophobicContact CB-CD1 3.75Å; D236-I239 HydrophobicContact CB-CG1 3.87Å; D236-I239 WeakPolarHBondContact OD2-CG1 3.49Å
237	P	95.3	Very high	95.4	Very high	17 Å²	17	45.2 Å²	45.2	11%	0.11	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-3.4	-178	35.8	-37.8	0	0	0	114	L215 L231 A235 P247 L263 H266 V268	L215-P237 HydrophobicContact CD2-CB 3.98Å; L231-P237 HydrophobicContact CD2-CB 4.25Å; A235-P237 WeakPolarHBondContact O-CD 3.42Å; P237-P247 VanDerWaalsContact O-CD 3.23Å; P237-P247 WeakPolarHBondContact O-CD 3.49Å; P237-P247 WeakPolarHBondContact O-CG 3.24Å; P237-L263 HydrophobicContact CB-CD2 3.84Å; P237-H266 HydrophobicContact CG-CB 4.48Å; P237-V268 HydrophobicContact CB-CG1 3.51Å; P237-V268 HydrophobicContact CG-CG1 3.5Å; P237-V268 VanDerWaalsContact CG-CG1 3.5Å
238	E	95.2	Very high	95.4	Very high	64 Å²	64	45.3 Å²	45.3	30%	0.299	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-21.1	177	-70.1	-61.1	121.4	0	0	113.4	D236 P240 V268 A269	D236-E238 VanDerWaalsContact C-N 3.26Å; D236-E238 PolarHBondContact O-N 3.26Å; D236-E238 WeakPolarHBondContact OD1-CB 3.35Å; D236-E238 PolarHBondContact OD1-N 3.25Å; E238-P240 WeakPolarHBondContact O-CD 3.38Å; E238-V268 WeakPolarHBondContact OE1-CA 3.37Å; E238-V268 VanDerWaalsContact OE1-CB 3.26Å; E238-V268 WeakPolarHBondContact OE1-CB 3.4Å; E238-A269 PolarHBondContact OE1-N 3.48Å; E238-A269 VanDerWaalsContact OE2-CB 3.3Å; E238-A269 WeakPolarHBondContact OE2-CB 3.3Å
239	I	95.3	Very high	95.4	Very high	34 Å²	34	42.3 Å²	42.3	17%	0.174	22%	0.216	C	C	.	.			trans	-66	115.9	-175.6	-57.5	177.7	0	0	0	110.6	N205 T213 D236 P247	N205-I239 HydrophobicContact CB-CD1 3.88Å; T213-I239 HydrophobicContact CG2-CB 3.83Å; T213-I239 HydrophobicContact CG2-CD1 4.2Å; T213-I239 HydrophobicContact CG2-CG2 3.59Å; D236-I239 HydrophobicContact CB-CD1 3.75Å; D236-I239 HydrophobicContact CB-CG1 3.87Å; D236-I239 WeakPolarHBondContact OD2-CG1 3.49Å; I239-P247 WeakPolarHBondContact O-CD 3.41Å
240	P	95.6	Very high	95.4	Very high	41 Å²	41	43.2 Å²	43.2	27%	0.266	22%	0.22	S	C	.	.			trans	-92.6	168.9	-178.9	37.5	-33.5	0	0	0	112.5	R207 E238 E245 T246	R207-P240 PolarHBondContact NH2-O 3.4Å; E238-P240 WeakPolarHBondContact O-CD 3.38Å; P240-E245 WeakPolarHBondContact CA-O 3.45Å; P240-E245 WeakPolarHBondContact CB-O 3.18Å; P240-T246 HydrophobicContact CB-CG2 4.33Å
241	N	95	Very high	95.4	Very high	13 Å²	13	43.2 Å²	43.2	7%	0.07	22%	0.22	C	C	.	.			trans	-73.4	-176.1	164.2	65.9	12	0	0	0	112.3	E212 L216 E243 K244 E245	E212-N241 HydrophobicContact CG-CB 4.05Å; L216-N241 HydrophobicContact CD2-CB 3.64Å; N241-E243 PolarHBondContact O-N 3.1Å; N241-E243 WeakPolarHBondContact OD1-CA 3.41Å; N241-E243 WeakPolarHBondContact OD1-CB 3.42Å; N241-E243 PolarHBondContact OD1-N 2.99Å; N241-K244 PolarHBondContact O-N 2.96Å; N241-K244 VanDerWaalsContact O-N 3.08Å; N241-K244 PolarHBondContact OD1-N 3.36Å; N241-E245 PolarHBondContact N-O 3.35Å; N241-E245 VanDerWaalsContact N-O 3.12Å; N241-E245 PolarHBondContact ND2-OE2 3.22Å; N241-E245 WeakPolarHBondContact OD1-CB 3.39Å; N241-E245 PolarHBondContact OD1-N 3.35Å
242	Y	94.6	Very high	95.5	Very high	143 Å²	143	42.9 Å²	42.9	56%	0.561	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-17.7	175.9	-62.1	-30.8	0	0	0	114.4	S209 R210 K244	S209-Y242 WeakPolarHBondContact O-CE2 3.36Å; R210-Y242 WeakPolarHBondContact O-CD2 3.44Å; R210-Y242 PolarHBondContact O-N 3.31Å; R210-Y242 VanDerWaalsContact O-N 3.13Å; Y242-K244 PolarHBondContact O-N 3.19Å
243	E	93.7	Very high	95.5	Very high	112 Å²	112	40 Å²	40	52%	0.523	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	9.2	170.8	-63	179.2	-147.4	0	0	112.4	N241 E245 I275	N241-E243 PolarHBondContact O-N 3.1Å; N241-E243 WeakPolarHBondContact OD1-CA 3.41Å; N241-E243 WeakPolarHBondContact OD1-CB 3.42Å; N241-E243 PolarHBondContact OD1-N 2.99Å; E243-E245 HydrophobicContact CB-CG 3.94Å; E243-E245 PolarHBondContact O-N 2.93Å; E243-I275 HydrophobicContact CB-CG2 4.16Å; E243-I275 VanDerWaalsContact O-CB 3.31Å; E243-I275 WeakPolarHBondContact O-CB 3.3Å; E243-I275 WeakPolarHBondContact O-CG2 3.37Å; E243-I275 PolarHBondContact O-N 3.28Å
244	K	95.1	Very high	95.6	Very high	126 Å²	126	42 Å²	42	55%	0.548	21%	0.207	S	C	.	.			trans	59	21.6	-175.9	-58.6	-176.1	175.6	-177.5	0	114.2	N241 Y242	N241-K244 PolarHBondContact O-N 2.96Å; N241-K244 VanDerWaalsContact O-N 3.08Å; N241-K244 PolarHBondContact OD1-N 3.36Å; Y242-K244 PolarHBondContact O-N 3.19Å
245	E	95.4	Very high	95.7	Very high	14 Å²	14	43.1 Å²	43.1	7%	0.065	20%	0.201	C	C	.	.			trans	-82.3	121.4	177	-53.3	179.9	113.9	0	0	109.7	P240 N241 E243 Y249 K250 C274	P240-E245 WeakPolarHBondContact CA-O 3.45Å; P240-E245 WeakPolarHBondContact CB-O 3.18Å; N241-E245 PolarHBondContact N-O 3.35Å; N241-E245 VanDerWaalsContact N-O 3.12Å; N241-E245 PolarHBondContact ND2-OE2 3.22Å; N241-E245 WeakPolarHBondContact OD1-CB 3.39Å; N241-E245 PolarHBondContact OD1-N 3.35Å; E243-E245 HydrophobicContact CB-CG 3.94Å; E243-E245 PolarHBondContact O-N 2.93Å; E245-Y249 HydrophobicContact CB-CD1 3.9Å; E245-Y249 HydrophobicContact CG-CD1 3.99Å; E245-Y249 HydrophobicContact CG-CE1 4.1Å; E245-Y249 VanDerWaalsContact OE1-CE1 3.24Å; E245-Y249 WeakPolarHBondContact OE1-CE1 3.37Å; E245-K250 HydrophobicContact CB-CG 4.36Å; E245-K250 VanDerWaalsContact CD-CE 3.47Å; E245-K250 WeakPolarHBondContact OE1-CE 3.29Å; E245-K250 IonicContact OE1-NZ 2.96Å; E245-K250 PolarHBondContact OE1-NZ 3.11Å; E245-K250 WeakPolarHBondContact OE2-CE 3.44Å; E245-K250 IonicContact OE2-NZ 3.34Å; E245-K250 PolarHBondContact OE2-NZ 2.93Å; E245-C274 HydrophobicContact CG-CB 4.07Å
246	T	96.2	Very high	95.7	Very high	7 Å²	7	43.6 Å²	43.6	4%	0.043	20%	0.204	C	C	.	.			trans	-81.3	160.7	175.4	60	0	0	0	0	111.4	P240 L248 Y249 K250 T272	P240-T246 HydrophobicContact CB-CG2 4.33Å; T246-L248 PolarHBondContact O-N 3.29Å; T246-Y249 WeakPolarHBondContact O-CB 3.4Å; T246-Y249 PolarHBondContact O-N 2.96Å; T246-Y249 PolarHBondContact OG1-N 2.81Å; T246-K250 PolarHBondContact O-N 2.88Å; T246-T272 HydrophobicContact CG2-CG2 3.59Å
247	P	96.7	Very high	95.7	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-45.6	-43.8	164.8	-32.9	36.7	0	0	0	113.3	L215 L216 V219 P237 I239 K250 A251 L263	L215-P247 HydrophobicContact CD2-CB 4.35Å; L215-P247 HydrophobicContact CD2-CG 4.16Å; L215-P247 HydrophobicContact CG-CB 4.35Å; L215-P247 HydrophobicContact CG-CG 4.28Å; L216-P247 HydrophobicContact CB-CG 4.45Å; L216-P247 HydrophobicContact CD1-CB 4.43Å; L216-P247 HydrophobicContact CD1-CG 4.12Å; V219-P247 WeakPolarHBondContact CG1-O 3.41Å; V219-P247 HydrophobicContact CG2-CB 4.38Å; P237-P247 VanDerWaalsContact O-CD 3.23Å; P237-P247 WeakPolarHBondContact O-CD 3.49Å; P237-P247 WeakPolarHBondContact O-CG 3.24Å; I239-P247 WeakPolarHBondContact O-CD 3.41Å; P247-K250 PolarHBondContact O-N 3.02Å; P247-A251 WeakPolarHBondContact O-CB 3.18Å; P247-A251 PolarHBondContact O-N 3.34Å; P247-L263 HydrophobicContact CB-CD1 4.04Å; P247-L263 HydrophobicContact CB-CD2 4.06Å
248	L	97.4	Very high	95.8	Very high	3 Å²	3	42.8 Å²	42.8	2%	0.016	21%	0.207	C	C	.	.	H	α-helix	trans	-62.9	-44.9	177.1	-177.2	68.9	0	0	0	112.3	T246 K250 A251 C252 V260 L263 L264 V268 V270 A280 L296	T246-L248 PolarHBondContact O-N 3.29Å; L248-K250 PolarHBondContact O-N 2.9Å; L248-A251 PolarHBondContact O-N 2.91Å; L248-C252 PolarHBondContact O-N 3.38Å; L248-C252 VanDerWaalsContact O-N 3.11Å; L248-C252 PolarHBondContact O-SG 3.15Å; L248-V260 HydrophobicContact CD1-CG1 3.94Å; L248-L263 HydrophobicContact CD1-CB 4.32Å; L248-L264 HydrophobicContact CD1-CD2 3.9Å; L248-L264 HydrophobicContact CD1-CG 4.17Å; L248-L264 HydrophobicContact CD2-CD2 4.16Å; L248-V268 HydrophobicContact CB-CG2 4.41Å; L248-V268 HydrophobicContact CD1-CG2 4.28Å; L248-V268 HydrophobicContact CD2-CG2 3.87Å; L248-V268 HydrophobicContact CG-CG2 4.41Å; L248-V270 HydrophobicContact CD2-CB 4.34Å; L248-V270 HydrophobicContact CD2-CG1 4.36Å; L248-V270 HydrophobicContact CD2-CG2 4.32Å; L248-A280 HydrophobicContact CD2-CB 4.25Å; L248-A280 HydrophobicContact CG-CB 4.2Å; L248-L296 HydrophobicContact CD1-CD2 4.12Å; L248-L296 HydrophobicContact CD2-CD2 4.07Å; L248-L296 HydrophobicContact CG-CD2 4.32Å
249	Y	96.4	Very high	95.8	Very high	18 Å²	18	39.8 Å²	39.8	7%	0.071	19%	0.193	C	C	.	.	H	α-helix	trans	-59.9	-46.7	177.3	-178.5	-86.8	0	0	0	111.3	E245 T246 C252 E253 C274 W278 E283	E245-Y249 HydrophobicContact CB-CD1 3.9Å; E245-Y249 HydrophobicContact CG-CD1 3.99Å; E245-Y249 HydrophobicContact CG-CE1 4.1Å; E245-Y249 VanDerWaalsContact OE1-CE1 3.24Å; E245-Y249 WeakPolarHBondContact OE1-CE1 3.37Å; T246-Y249 WeakPolarHBondContact O-CB 3.4Å; T246-Y249 PolarHBondContact O-N 2.96Å; T246-Y249 PolarHBondContact OG1-N 2.81Å; Y249-C252 WeakPolarHBondContact O-CB 3.44Å; Y249-C252 PolarHBondContact O-N 3.09Å; Y249-E253 PolarHBondContact O-N 2.71Å; Y249-C274 HydrophobicContact CE2-CB 4.35Å; Y249-W278 HydrophobicContact CE2-CB 3.94Å; Y249-E283 HydrophobicContact CE2-CB 4.09Å
250	K	96.1	Very high	96	Very high	20 Å²	20	38.1 Å²	38.1	9%	0.087	19%	0.185	C	C	.	.	H	α-helix	trans	-68.2	-33.5	177.1	-77.4	-50.6	-154.5	-154.4	0	113.2	L216 V219 E245 T246 P247 L248 C252 E253 R254	L216-K250 HydrophobicContact CD1-CB 3.94Å; L216-K250 HydrophobicContact CD1-CG 3.8Å; V219-K250 HydrophobicContact CG1-CB 3.98Å; E245-K250 HydrophobicContact CB-CG 4.36Å; E245-K250 VanDerWaalsContact CD-CE 3.47Å; E245-K250 WeakPolarHBondContact OE1-CE 3.29Å; E245-K250 IonicContact OE1-NZ 2.96Å; E245-K250 PolarHBondContact OE1-NZ 3.11Å; E245-K250 WeakPolarHBondContact OE2-CE 3.44Å; E245-K250 IonicContact OE2-NZ 3.34Å; E245-K250 PolarHBondContact OE2-NZ 2.93Å; T246-K250 PolarHBondContact O-N 2.88Å; P247-K250 PolarHBondContact O-N 3.02Å; L248-K250 PolarHBondContact O-N 2.9Å; K250-C252 PolarHBondContact O-N 2.98Å; K250-E253 HydrophobicContact CD-CB 4.27Å; K250-E253 VanDerWaalsContact CD-OE2 3.3Å; K250-E253 WeakPolarHBondContact CD-OE2 3.1Å; K250-E253 IonicContact NZ-OE1 3.8Å; K250-E253 PolarHBondContact NZ-OE1 3.35Å; K250-E253 IonicContact NZ-OE2 2.92Å; K250-E253 PolarHBondContact NZ-OE2 2.89Å; K250-E253 PolarHBondContact O-N 2.93Å; K250-R254 WeakPolarHBondContact O-CB 3.47Å; K250-R254 WeakPolarHBondContact O-CG 3.48Å; K250-R254 PolarHBondContact O-N 2.92Å
251	A	96.9	Very high	96	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.5	-35.6	173.2	0	0	0	0	0	112	V219 P247 L248 N255 S256 I259 V260 L263	V219-A251 HydrophobicContact CG1-CB 3.78Å; V219-A251 VanDerWaalsContact CG1-N 3.32Å; P247-A251 WeakPolarHBondContact O-CB 3.18Å; P247-A251 PolarHBondContact O-N 3.34Å; L248-A251 PolarHBondContact O-N 2.91Å; A251-N255 PolarHBondContact O-N 3.43Å; A251-S256 PolarHBondContact O-N 3.17Å; A251-S256 VanDerWaalsContact O-N 3.1Å; A251-I259 HydrophobicContact CB-CB 4.28Å; A251-I259 HydrophobicContact CB-CG2 3.61Å; A251-V260 HydrophobicContact CB-CG2 3.59Å; A251-L263 HydrophobicContact CB-CD1 3.84Å
252	C	96.7	Very high	96.1	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-70.7	-44.9	174.1	-64.5	0	0	0	0	112.7	L248 Y249 K250 R254 N255 A280 E283 T284	L248-C252 PolarHBondContact O-N 3.38Å; L248-C252 VanDerWaalsContact O-N 3.11Å; L248-C252 PolarHBondContact O-SG 3.15Å; Y249-C252 WeakPolarHBondContact O-CB 3.44Å; Y249-C252 PolarHBondContact O-N 3.09Å; K250-C252 PolarHBondContact O-N 2.98Å; C252-R254 VanDerWaalsContact C-N 3.27Å; C252-R254 PolarHBondContact O-N 3.14Å; C252-N255 PolarHBondContact O-N 3.25Å; C252-A280 HydrophobicContact CB-CB 4.49Å; C252-E283 HydrophobicContact CB-CG 4.46Å; C252-T284 HydrophobicContact CB-CG2 3.53Å
253	E	95.4	Very high	96.2	Very high	37 Å²	37	31.1 Å²	31.1	17%	0.173	16%	0.162	C	C	.	.	H	α-helix	trans	-56.3	-42.2	172.9	-175.7	-157	-119.2	0	0	111.6	Y249 K250 N255 E283 R287	Y249-E253 PolarHBondContact O-N 2.71Å; K250-E253 HydrophobicContact CD-CB 4.27Å; K250-E253 VanDerWaalsContact CD-OE2 3.3Å; K250-E253 WeakPolarHBondContact CD-OE2 3.1Å; K250-E253 IonicContact NZ-OE1 3.8Å; K250-E253 PolarHBondContact NZ-OE1 3.35Å; K250-E253 IonicContact NZ-OE2 2.92Å; K250-E253 PolarHBondContact NZ-OE2 2.89Å; K250-E253 PolarHBondContact O-N 2.93Å; E253-N255 PolarHBondContact O-N 3.5Å; E253-E283 WeakPolarHBondContact CA-OE1 3.45Å; E253-E283 HydrophobicContact CB-CG 3.96Å; E253-R287 PolarHBondContact O-NE 2.94Å
254	R	95.8	Very high	96.3	Very high	112 Å²	112	27.1 Å²	27.1	42%	0.423	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	0.6	177.9	-59.1	-66.3	145.4	165.2	-4.4	113.7	S220 V222 K250 C252 S256	S220-R254 WeakPolarHBondContact O-CD 3.46Å; S220-R254 PolarHBondContact O-NH1 3.13Å; V222-R254 HydrophobicContact CG2-CB 3.87Å; V222-R254 HydrophobicContact CG2-CG 4.23Å; K250-R254 WeakPolarHBondContact O-CB 3.47Å; K250-R254 WeakPolarHBondContact O-CG 3.48Å; K250-R254 PolarHBondContact O-N 2.92Å; C252-R254 VanDerWaalsContact C-N 3.27Å; C252-R254 PolarHBondContact O-N 3.14Å; R254-S256 PolarHBondContact O-N 2.93Å
255	N	95.4	Very high	96.2	Very high	74 Å²	74	27.8 Å²	27.8	40%	0.396	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	34	176.5	-162.6	34.7	0	0	0	114.2	A251 C252 E253 N289	A251-N255 PolarHBondContact O-N 3.43Å; C252-N255 PolarHBondContact O-N 3.25Å; E253-N255 PolarHBondContact O-N 3.5Å; N255-N289 WeakPolarHBondContact OD1-CB 3.35Å; N255-N289 PolarHBondContact OD1-ND2 3.2Å
256	S	95.8	Very high	96.1	Very high	17 Å²	17	31.9 Å²	31.9	12%	0.119	17%	0.172	C	C	.	.			trans	-102	96.1	-174.2	-173.9	0	0	0	0	111.9	A251 R254 A258 I259 V260	A251-S256 PolarHBondContact O-N 3.17Å; A251-S256 VanDerWaalsContact O-N 3.1Å; R254-S256 PolarHBondContact O-N 2.93Å; S256-A258 VanDerWaalsContact C-N 3.33Å; S256-A258 PolarHBondContact O-N 3.43Å; S256-I259 PolarHBondContact O-N 3.5Å; S256-I259 WeakPolarHBondContact OG-CG1 3.41Å; S256-V260 WeakPolarHBondContact O-CG2 3.18Å; S256-V260 PolarHBondContact O-N 2.94Å
257	A	96.1	Very high	95.8	Very high	20 Å²	20	34.8 Å²	34.8	17%	0.165	20%	0.204	C	C	.	.	H	α-helix	trans	-56.3	-43.5	-179.7	0	0	0	0	0	112.9	I259 V260 A261 I292 M295	A257-I259 PolarHBondContact O-N 2.93Å; A257-V260 PolarHBondContact O-N 3.36Å; A257-A261 WeakPolarHBondContact O-CB 3.44Å; A257-A261 PolarHBondContact O-N 3.22Å; A257-I292 HydrophobicContact CB-CD1 4.44Å; A257-I292 HydrophobicContact CB-CG1 4.1Å; A257-M295 HydrophobicContact CB-CE 3.8Å
258	A	96.3	Very high	95.7	Very high	43 Å²	43	35.4 Å²	35.4	36%	0.355	21%	0.208	S	C	.	.	H	α-helix	trans	-62.8	-40.1	179.7	0	0	0	0	0	113.3	S256 A262	S256-A258 VanDerWaalsContact C-N 3.33Å; S256-A258 PolarHBondContact O-N 3.43Å; A258-A262 WeakPolarHBondContact O-CB 3.43Å; A258-A262 PolarHBondContact O-N 2.81Å
259	I	96.9	Very high	95.6	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-72.4	-38.2	177.2	-65.8	177.5	0	0	0	110.6	V219 V222 Q224 V227 A251 S256 A257 A262 L263	V219-I259 HydrophobicContact CB-CG2 4.46Å; V219-I259 HydrophobicContact CG1-CG2 4.12Å; V219-I259 HydrophobicContact CG2-CG2 3.82Å; V222-I259 HydrophobicContact CB-CD1 4.39Å; V222-I259 HydrophobicContact CG1-CD1 3.87Å; Q224-I259 HydrophobicContact CB-CG1 4.45Å; V227-I259 HydrophobicContact CG1-CG2 4.34Å; V227-I259 HydrophobicContact CG2-CD1 4.24Å; V227-I259 HydrophobicContact CG2-CG1 4.48Å; V227-I259 HydrophobicContact CG2-CG2 4.38Å; A251-I259 HydrophobicContact CB-CB 4.28Å; A251-I259 HydrophobicContact CB-CG2 3.61Å; S256-I259 PolarHBondContact O-N 3.5Å; S256-I259 WeakPolarHBondContact OG-CG1 3.41Å; A257-I259 PolarHBondContact O-N 2.93Å; I259-A262 PolarHBondContact O-N 2.94Å; I259-L263 HydrophobicContact CG2-CD1 3.96Å; I259-L263 HydrophobicContact CG2-CG 4.45Å; I259-L263 VanDerWaalsContact O-CG 3.32Å; I259-L263 WeakPolarHBondContact O-CG 3.5Å; I259-L263 PolarHBondContact O-N 2.85Å
260	V	97.6	Very high	95.5	Very high	0 Å²	0	37 Å²	37	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-61.6	-48	173.6	172.5	0	0	0	0	110.6	L248 A251 S256 A257 A262 L263 L264 I292 M295 L296	L248-V260 HydrophobicContact CD1-CG1 3.94Å; A251-V260 HydrophobicContact CB-CG2 3.59Å; S256-V260 WeakPolarHBondContact O-CG2 3.18Å; S256-V260 PolarHBondContact O-N 2.94Å; A257-V260 PolarHBondContact O-N 3.36Å; V260-A262 VanDerWaalsContact C-N 3.34Å; V260-A262 PolarHBondContact O-N 3.23Å; V260-L263 PolarHBondContact O-N 2.99Å; V260-L264 HydrophobicContact CG1-CD1 3.65Å; V260-L264 HydrophobicContact CG1-CG 4.01Å; V260-L264 WeakPolarHBondContact O-CB 3.43Å; V260-L264 VanDerWaalsContact O-CG 3.27Å; V260-L264 WeakPolarHBondContact O-CG 3.36Å; V260-L264 PolarHBondContact O-N 3.14Å; V260-I292 HydrophobicContact CB-CG2 4.08Å; V260-I292 HydrophobicContact CG1-CG2 3.81Å; V260-I292 HydrophobicContact CG2-CG2 3.8Å; V260-M295 HydrophobicContact CB-CE 4.32Å; V260-M295 HydrophobicContact CG1-CE 4.24Å; V260-L296 HydrophobicContact CG1-CD2 4.36Å
261	A	96.8	Very high	95.5	Very high	32 Å²	32	38.5 Å²	38.5	26%	0.264	23%	0.233	S	C	.	.	H	α-helix	trans	-57.5	-44.7	176.4	0	0	0	0	0	112.3	A257 L263 L264 N265 M295	A257-A261 WeakPolarHBondContact O-CB 3.44Å; A257-A261 PolarHBondContact O-N 3.22Å; A261-L263 PolarHBondContact O-N 2.92Å; A261-L264 PolarHBondContact O-N 3.02Å; A261-N265 PolarHBondContact O-N 3.05Å; A261-N265 PolarHBondContact O-ND2 3.35Å; A261-M295 HydrophobicContact CB-SD 3.96Å
262	A	96	Very high	95.4	Very high	18 Å²	18	40.8 Å²	40.8	15%	0.149	25%	0.247	C	C	.	.	H	α-helix	trans	-59.2	-46.6	176	0	0	0	0	0	112.1	L231 A258 I259 V260 N265 H266	L231-A262 HydrophobicContact CD1-CB 4.36Å; A258-A262 WeakPolarHBondContact O-CB 3.43Å; A258-A262 PolarHBondContact O-N 2.81Å; I259-A262 PolarHBondContact O-N 2.94Å; V260-A262 VanDerWaalsContact C-N 3.34Å; V260-A262 PolarHBondContact O-N 3.23Å; A262-N265 PolarHBondContact O-N 3.49Å; A262-H266 PolarHBondContact O-CD2 2.93Å
263	L	96.7	Very high	95.3	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-67	-41.6	178.8	-68.1	168.6	0	0	0	112.3	L215 V219 L231 P237 P247 L248 A251 I259 V260 A261 N265 H266 V268	L215-L263 HydrophobicContact CD2-CD2 4.35Å; V219-L263 HydrophobicContact CG2-CD1 4.34Å; L231-L263 HydrophobicContact CD1-CD2 4.26Å; L231-L263 HydrophobicContact CD2-CD2 4.25Å; P237-L263 HydrophobicContact CB-CD2 3.84Å; P247-L263 HydrophobicContact CB-CD1 4.04Å; P247-L263 HydrophobicContact CB-CD2 4.06Å; L248-L263 HydrophobicContact CD1-CB 4.32Å; A251-L263 HydrophobicContact CB-CD1 3.84Å; I259-L263 HydrophobicContact CG2-CD1 3.96Å; I259-L263 HydrophobicContact CG2-CG 4.45Å; I259-L263 VanDerWaalsContact O-CG 3.32Å; I259-L263 WeakPolarHBondContact O-CG 3.5Å; I259-L263 PolarHBondContact O-N 2.85Å; V260-L263 PolarHBondContact O-N 2.99Å; A261-L263 PolarHBondContact O-N 2.92Å; L263-N265 VanDerWaalsContact C-N 3.32Å; L263-N265 PolarHBondContact O-N 3.25Å; L263-H266 PolarHBondContact O-N 3.25Å; L263-H266 VanDerWaalsContact O-N 3.09Å; L263-V268 HydrophobicContact CB-CG1 4.47Å; L263-V268 HydrophobicContact CB-CG2 4.49Å; L263-V268 WeakPolarHBondContact O-CG1 3.28Å; L263-V268 WeakPolarHBondContact O-CG2 3.43Å
264	L	96.1	Very high	95.2	Very high	27 Å²	27	44.4 Å²	44.4	14%	0.141	26%	0.261	C	S	.	.	H	α-helix	trans	-62.5	-37.1	177.8	-69	179	0	0	0	112.5	L248 V260 A261 H266 G267 V268 V270 M295 L296 A299	L248-L264 HydrophobicContact CD1-CD2 3.9Å; L248-L264 HydrophobicContact CD1-CG 4.17Å; L248-L264 HydrophobicContact CD2-CD2 4.16Å; V260-L264 HydrophobicContact CG1-CD1 3.65Å; V260-L264 HydrophobicContact CG1-CG 4.01Å; V260-L264 WeakPolarHBondContact O-CB 3.43Å; V260-L264 VanDerWaalsContact O-CG 3.27Å; V260-L264 WeakPolarHBondContact O-CG 3.36Å; V260-L264 PolarHBondContact O-N 3.14Å; A261-L264 PolarHBondContact O-N 3.02Å; L264-H266 PolarHBondContact O-N 3.38Å; L264-G267 PolarHBondContact O-N 2.95Å; L264-V268 HydrophobicContact CD2-CG2 3.81Å; L264-V270 HydrophobicContact CD2-CG2 3.67Å; L264-M295 HydrophobicContact CD1-CB 3.85Å; L264-L296 HydrophobicContact CD2-CD2 4.38Å; L264-A299 HydrophobicContact CD1-CB 4.12Å; L264-A299 HydrophobicContact CD2-CB 3.69Å; L264-A299 HydrophobicContact CG-CB 4.36Å
265	N	94.3	Very high	95.1	Very high	141 Å²	141	43.7 Å²	43.7	75%	0.754	26%	0.264	S	S	*	.	H	α-helix	trans	-63.2	-20.3	175	-71.3	-20.2	0	0	0	113.6	A261 A262 L263	A261-N265 PolarHBondContact O-N 3.05Å; A261-N265 PolarHBondContact O-ND2 3.35Å; A262-N265 PolarHBondContact O-N 3.49Å; L263-N265 VanDerWaalsContact C-N 3.32Å; L263-N265 PolarHBondContact O-N 3.25Å
266	H	93	Very high	95	Very high	99 Å²	99	44.2 Å²	44.2	46%	0.458	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	8	174.7	-79.5	-103.8	0	0	0	113.8	P237 A262 L263 L264	P237-H266 HydrophobicContact CG-CB 4.48Å; A262-H266 PolarHBondContact O-CD2 2.93Å; L263-H266 PolarHBondContact O-N 3.25Å; L263-H266 VanDerWaalsContact O-N 3.09Å; L264-H266 PolarHBondContact O-N 3.38Å
267	G	88.7	Confident	94.9	Very high	69 Å²	69	43.7 Å²	43.7	71%	0.711	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.3	25.6	170	0	0	0	0	0	115.8	L264	L264-G267 PolarHBondContact O-N 2.95Å
268	V	94.4	Very high	94.8	Very high	12 Å²	12	44.9 Å²	44.9	7%	0.073	26%	0.262	C	S	.	.			trans	-59.7	150.8	-178.8	-68.3	0	0	0	0	114.8	P237 E238 L248 L263 L264 V270	P237-V268 HydrophobicContact CB-CG1 3.51Å; P237-V268 HydrophobicContact CG-CG1 3.5Å; P237-V268 VanDerWaalsContact CG-CG1 3.5Å; E238-V268 WeakPolarHBondContact OE1-CA 3.37Å; E238-V268 VanDerWaalsContact OE1-CB 3.26Å; E238-V268 WeakPolarHBondContact OE1-CB 3.4Å; L248-V268 HydrophobicContact CB-CG2 4.41Å; L248-V268 HydrophobicContact CD1-CG2 4.28Å; L248-V268 HydrophobicContact CD2-CG2 3.87Å; L248-V268 HydrophobicContact CG-CG2 4.41Å; L263-V268 HydrophobicContact CB-CG1 4.47Å; L263-V268 HydrophobicContact CB-CG2 4.49Å; L263-V268 WeakPolarHBondContact O-CG1 3.28Å; L263-V268 WeakPolarHBondContact O-CG2 3.43Å; L264-V268 HydrophobicContact CD2-CG2 3.81Å; V268-V270 PolarHBondContact O-N 3.21Å
269	A	95.1	Very high	94.7	Very high	46 Å²	46	43 Å²	43	38%	0.38	25%	0.246	S	C	.	.			trans	-75.5	91.7	176.1	0	0	0	0	0	111.4	E238 N271 T272	E238-A269 PolarHBondContact OE1-N 3.48Å; E238-A269 VanDerWaalsContact OE2-CB 3.3Å; E238-A269 WeakPolarHBondContact OE2-CB 3.3Å; A269-N271 PolarHBondContact O-N 2.66Å; A269-N271 VanDerWaalsContact O-N 3.07Å; A269-T272 WeakPolarHBondContact CB-OG1 3.27Å; A269-T272 WeakPolarHBondContact O-CB 3.21Å; A269-T272 PolarHBondContact O-N 3.4Å; A269-T272 PolarHBondContact O-OG1 3.46Å; A269-T272 VanDerWaalsContact O-OG1 3.1Å
270	V	95.6	Very high	94.6	Very high	9 Å²	9	43 Å²	43	6%	0.055	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-27.7	-175.8	-174.2	0	0	0	0	114.7	L248 L264 V268 L296 A299 A301	L248-V270 HydrophobicContact CD2-CB 4.34Å; L248-V270 HydrophobicContact CD2-CG1 4.36Å; L248-V270 HydrophobicContact CD2-CG2 4.32Å; L264-V270 HydrophobicContact CD2-CG2 3.67Å; V268-V270 PolarHBondContact O-N 3.21Å; V270-L296 HydrophobicContact CG1-CB 4.27Å; V270-L296 HydrophobicContact CG1-CD2 3.81Å; V270-A299 HydrophobicContact CG2-CB 3.69Å; V270-A299 WeakPolarHBondContact CG2-O 3.33Å; V270-A301 HydrophobicContact CG1-CB 3.6Å
271	N	95.6	Very high	94.6	Very high	51 Å²	51	43.2 Å²	43.2	27%	0.273	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	8.1	-174.3	-68.5	-67.1	0	0	0	114.2	A269 G300 K302 L305	A269-N271 PolarHBondContact O-N 2.66Å; A269-N271 VanDerWaalsContact O-N 3.07Å; N271-G300 PolarHBondContact ND2-O 3.04Å; N271-K302 WeakPolarHBondContact OD1-CB 3.37Å; N271-K302 PolarHBondContact OD1-N 2.86Å; N271-L305 HydrophobicContact CB-CD1 3.94Å; N271-L305 WeakPolarHBondContact OD1-CD1 3.47Å
272	T	94.4	Very high	94.5	Very high	49 Å²	49	41.7 Å²	41.7	30%	0.301	24%	0.235	S	C	.	.			trans	-63.3	144.7	177.1	-62.1	0	0	0	0	111.2	T246 A269	T246-T272 HydrophobicContact CG2-CG2 3.59Å; A269-T272 WeakPolarHBondContact CB-OG1 3.27Å; A269-T272 WeakPolarHBondContact O-CB 3.21Å; A269-T272 PolarHBondContact O-N 3.4Å; A269-T272 PolarHBondContact O-OG1 3.46Å; A269-T272 VanDerWaalsContact O-OG1 3.1Å
273	R	94.4	Very high	94.4	Very high	103 Å²	103	41.5 Å²	41.5	39%	0.389	23%	0.231	S	C	.	.	B	Isolated β-bridge	trans	-117.6	132.6	-171.5	-66.1	174.3	66.1	-179.2	-6.1	111.3	G277 W278 T279 R306 N307	R273-G277 PolarHBondContact NE-O 2.88Å; R273-G277 PolarHBondContact NH2-O 3.4Å; R273-W278 VanDerWaalsContact CA-O 3.26Å; R273-W278 WeakPolarHBondContact CA-O 3.4Å; R273-T279 HydrophobicContact CG-CG2 3.91Å; R273-R306 PolarHBondContact NH1-O 3.24Å; R273-R306 PolarHBondContact NH2-O 2.76Å; R273-N307 VanDerWaalsContact NH2-C 3.28Å; R273-N307 PolarHBondContact NH2-O 3.38Å
274	C	93.8	Very high	94.3	Very high	10 Å²	10	41.5 Å²	41.5	7%	0.068	23%	0.231	C	C	.	.			trans	-68.5	-179.8	173.2	78	0	0	0	0	111.7	E245 Y249 Q276 G277 W278	E245-C274 HydrophobicContact CG-CB 4.07Å; Y249-C274 HydrophobicContact CE2-CB 4.35Å; C274-Q276 PolarHBondContact O-N 2.92Å; C274-Q276 PolarHBondContact SG-N 2.97Å; C274-G277 WeakPolarHBondContact O-CA 3.45Å; C274-G277 PolarHBondContact O-N 2.79Å; C274-W278 PolarHBondContact N-O 3.25Å; C274-W278 PolarHBondContact SG-N 2.9Å
275	I	94.6	Very high	94.3	Very high	97 Å²	97	40.2 Å²	40.2	50%	0.497	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-32.5	-179.7	-165.7	167.6	0	0	0	112.9	E243 G277 M308	E243-I275 HydrophobicContact CB-CG2 4.16Å; E243-I275 VanDerWaalsContact O-CB 3.31Å; E243-I275 WeakPolarHBondContact O-CB 3.3Å; E243-I275 WeakPolarHBondContact O-CG2 3.37Å; E243-I275 PolarHBondContact O-N 3.28Å; I275-G277 PolarHBondContact O-N 3.29Å; I275-M308 VanDerWaalsContact O-CE 3.24Å; I275-M308 WeakPolarHBondContact O-CE 3.32Å
276	Q	92.6	Very high	94.2	Very high	84 Å²	84	35.7 Å²	35.7	39%	0.393	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	2.2	173.3	-61.7	-172.3	2.2	0	0	113.5	C274 W278 M308	C274-Q276 PolarHBondContact O-N 2.92Å; C274-Q276 PolarHBondContact SG-N 2.97Å; Q276-W278 VanDerWaalsContact C-N 3.29Å; Q276-W278 PolarHBondContact O-N 3.27Å; Q276-M308 VanDerWaalsContact CA-SD 3.58Å; Q276-M308 HydrophobicContact CB-SD 4.07Å; Q276-M308 HydrophobicContact CG-SD 4.39Å; Q276-M308 WeakPolarHBondContact O-CB 3.17Å; Q276-M308 VanDerWaalsContact O-CG 3.27Å; Q276-M308 WeakPolarHBondContact O-CG 3.49Å; Q276-M308 PolarHBondContact O-N 2.71Å; Q276-M308 VanDerWaalsContact O-N 3.14Å
277	G	93.4	Very high	94.2	Very high	7 Å²	7	36.4 Å²	36.4	7%	0.072	20%	0.201	C	C	.	.			trans	77.1	5.8	-178.4	0	0	0	0	0	114.9	R273 C274 I275 N307	R273-G277 PolarHBondContact NE-O 2.88Å; R273-G277 PolarHBondContact NH2-O 3.4Å; C274-G277 WeakPolarHBondContact O-CA 3.45Å; C274-G277 PolarHBondContact O-N 2.79Å; I275-G277 PolarHBondContact O-N 3.29Å; G277-N307 WeakPolarHBondContact O-CA 3.37Å
278	W	94.4	Very high	94.2	Very high	44 Å²	44	35.6 Å²	35.6	17%	0.167	18%	0.184	C	C	.	.			trans	-71.9	146.7	178.8	-72.1	58.5	0	0	0	111.7	Y249 R273 C274 Q276 Q282 V286 N307 T316	Y249-W278 HydrophobicContact CE2-CB 3.94Å; R273-W278 VanDerWaalsContact CA-O 3.26Å; R273-W278 WeakPolarHBondContact CA-O 3.4Å; C274-W278 PolarHBondContact N-O 3.25Å; C274-W278 PolarHBondContact SG-N 2.9Å; Q276-W278 VanDerWaalsContact C-N 3.29Å; Q276-W278 PolarHBondContact O-N 3.27Å; W278-Q282 HydrophobicContact CD2-CG 4.22Å; W278-Q282 HydrophobicContact CE3-CB 3.95Å; W278-Q282 HydrophobicContact CE3-CG 3.58Å; W278-Q282 HydrophobicContact CZ3-CB 4.47Å; W278-Q282 HydrophobicContact CZ3-CG 3.76Å; W278-V286 HydrophobicContact CH2-CG2 3.9Å; W278-V286 HydrophobicContact CZ3-CG2 3.62Å; W278-N307 HydrophobicContact CG-CB 4.38Å; W278-N307 PolarHBondContact NE1-ND2 3.12Å; W278-T316 HydrophobicContact CH2-CG2 4.4Å
279	T	94.6	Very high	94.1	Very high	3 Å²	3	36.4 Å²	36.4	2%	0.018	19%	0.188	C	C	.	.	B	Isolated β-bridge	trans	-99.2	161.4	173.1	61.2	0	0	0	0	111.1	R273 L281 Q282 E283 L305	R273-T279 HydrophobicContact CG-CG2 3.91Å; T279-L281 PolarHBondContact O-N 3.21Å; T279-Q282 PolarHBondContact O-N 3.26Å; T279-Q282 VanDerWaalsContact O-N 3.11Å; T279-Q282 PolarHBondContact OG1-N 3.13Å; T279-E283 PolarHBondContact O-N 3.14Å; T279-L305 HydrophobicContact CG2-CB 3.98Å; T279-L305 HydrophobicContact CG2-CD1 3.73Å
280	A	95.4	Very high	94.1	Very high	3 Å²	3	37.2 Å²	37.2	3%	0.025	19%	0.185	C	C	.	.	H	α-helix	trans	-53.3	-41.8	171.7	0	0	0	0	0	112.1	L248 C252 Q282 E283 T284 L296	L248-A280 HydrophobicContact CD2-CB 4.25Å; L248-A280 HydrophobicContact CG-CB 4.2Å; C252-A280 HydrophobicContact CB-CB 4.49Å; A280-Q282 PolarHBondContact O-N 3.34Å; A280-E283 PolarHBondContact O-N 2.81Å; A280-T284 WeakPolarHBondContact O-CG2 3.49Å; A280-T284 PolarHBondContact O-N 3.39Å; A280-L296 HydrophobicContact CB-CD1 4.28Å; A280-L296 HydrophobicContact CB-CD2 4.24Å
281	L	96.4	Very high	94.2	Very high	3 Å²	3	42.4 Å²	42.4	2%	0.016	21%	0.209	C	C	.	.	H	α-helix	trans	-60.6	-43.2	176.6	-179.9	64.5	0	0	0	112.3	T279 E283 T284 V285 C293 L296 L297 A301 L303 P313	T279-L281 PolarHBondContact O-N 3.21Å; L281-E283 VanDerWaalsContact C-N 3.33Å; L281-E283 PolarHBondContact O-N 3Å; L281-T284 WeakPolarHBondContact CA-OG1 2.98Å; L281-T284 PolarHBondContact O-N 3.13Å; L281-T284 PolarHBondContact O-OG1 2.9Å; L281-V285 WeakPolarHBondContact O-CG2 3.19Å; L281-V285 PolarHBondContact O-N 2.96Å; L281-C293 HydrophobicContact CD1-CB 4.19Å; L281-L296 HydrophobicContact CB-CD1 4.3Å; L281-L296 HydrophobicContact CD1-CD1 4.43Å; L281-L297 HydrophobicContact CD2-CD2 4.18Å; L281-A301 HydrophobicContact CB-CB 4.27Å; L281-A301 HydrophobicContact CD2-CB 4.07Å; L281-L303 HydrophobicContact CD2-CD2 4.3Å; L281-P313 HydrophobicContact CD2-CG 4.31Å; L281-P313 HydrophobicContact CG-CG 4.4Å
282	Q	94.3	Very high	94.3	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-64.9	-38.9	179.8	-165.1	171.6	5.9	0	0	112	W278 T279 A280 V285 V286 I311 P313 T316	W278-Q282 HydrophobicContact CD2-CG 4.22Å; W278-Q282 HydrophobicContact CE3-CB 3.95Å; W278-Q282 HydrophobicContact CE3-CG 3.58Å; W278-Q282 HydrophobicContact CZ3-CB 4.47Å; W278-Q282 HydrophobicContact CZ3-CG 3.76Å; T279-Q282 PolarHBondContact O-N 3.26Å; T279-Q282 VanDerWaalsContact O-N 3.11Å; T279-Q282 PolarHBondContact OG1-N 3.13Å; A280-Q282 PolarHBondContact O-N 3.34Å; Q282-V285 PolarHBondContact O-N 3.02Å; Q282-V286 PolarHBondContact O-N 2.94Å; Q282-I311 PolarHBondContact NE2-O 2.9Å; Q282-P313 HydrophobicContact CB-CG 4.15Å; Q282-P313 HydrophobicContact CG-CG 4.4Å; Q282-T316 PolarHBondContact NE2-OG1 2.87Å; Q282-T316 VanDerWaalsContact NE2-OG1 3.09Å
283	E	94.9	Very high	94.4	Very high	14 Å²	14	37.7 Å²	37.7	7%	0.065	18%	0.182	C	C	.	.	H	α-helix	trans	-64	-45	173	-178.4	58.4	-153.3	0	0	111.5	Y249 C252 E253 T279 A280 L281 V285 V286 R287	Y249-E283 HydrophobicContact CE2-CB 4.09Å; C252-E283 HydrophobicContact CB-CG 4.46Å; E253-E283 WeakPolarHBondContact CA-OE1 3.45Å; E253-E283 HydrophobicContact CB-CG 3.96Å; T279-E283 PolarHBondContact O-N 3.14Å; A280-E283 PolarHBondContact O-N 2.81Å; L281-E283 VanDerWaalsContact C-N 3.33Å; L281-E283 PolarHBondContact O-N 3Å; E283-V285 PolarHBondContact O-N 3.12Å; E283-V286 WeakPolarHBondContact O-CB 3.24Å; E283-V286 PolarHBondContact O-N 3.31Å; E283-V286 VanDerWaalsContact O-N 3.12Å; E283-R287 WeakPolarHBondContact O-CG 3.43Å; E283-R287 PolarHBondContact O-N 3.39Å; E283-R287 VanDerWaalsContact O-N 3.1Å; E283-R287 IonicContact OE1-CZ 2.94Å; E283-R287 IonicContact OE1-NE 3.31Å; E283-R287 PolarHBondContact OE1-NE 3.4Å; E283-R287 IonicContact OE1-NH2 2.73Å; E283-R287 PolarHBondContact OE1-NH2 3.36Å
284	T	95.1	Very high	94.5	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.4	-32.1	176.9	55.8	0	0	0	0	113.9	C252 A280 L281 R287 S288 N289 I292 C293 L296	C252-T284 HydrophobicContact CB-CG2 3.53Å; A280-T284 WeakPolarHBondContact O-CG2 3.49Å; A280-T284 PolarHBondContact O-N 3.39Å; L281-T284 WeakPolarHBondContact CA-OG1 2.98Å; L281-T284 PolarHBondContact O-N 3.13Å; L281-T284 PolarHBondContact O-OG1 2.9Å; T284-R287 CarbonylContact O-C 3.44Å; T284-R287 PolarHBondContact O-N 2.84Å; T284-S288 PolarHBondContact O-N 2.97Å; T284-N289 PolarHBondContact O-N 2.84Å; T284-I292 HydrophobicContact CG2-CB 3.88Å; T284-I292 HydrophobicContact CG2-CG2 3.46Å; T284-I292 VanDerWaalsContact CG2-CG2 3.46Å; T284-C293 PolarHBondContact OG1-SG 3.42Å; T284-C293 VanDerWaalsContact OG1-SG 3.35Å; T284-L296 HydrophobicContact CG2-CD1 3.57Å
285	V	94.9	Very high	94.7	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-66.3	-44.2	175.2	166.3	0	0	0	0	110.5	L281 Q282 E283 R287 S288 P313 A317 Q322 A325 L329	L281-V285 WeakPolarHBondContact O-CG2 3.19Å; L281-V285 PolarHBondContact O-N 2.96Å; Q282-V285 PolarHBondContact O-N 3.02Å; E283-V285 PolarHBondContact O-N 3.12Å; V285-R287 PolarHBondContact O-N 2.96Å; V285-S288 WeakPolarHBondContact O-CA 3.4Å; V285-S288 PolarHBondContact O-N 3.49Å; V285-P313 HydrophobicContact CG2-CB 4.2Å; V285-A317 HydrophobicContact CG1-CB 3.75Å; V285-Q322 PolarHBondContact O-NE2 2.92Å; V285-Q322 PolarHBondContact O-OE1 3.37Å; V285-A325 HydrophobicContact CG1-CB 4.15Å; V285-L329 HydrophobicContact CG1-CD1 4.29Å; V285-L329 HydrophobicContact CG2-CD1 3.95Å; V285-L329 HydrophobicContact CG2-CD2 4.2Å; V285-L329 HydrophobicContact CG2-CG 4.41Å
286	V	92.4	Very high	94.8	Very high	46 Å²	46	31.6 Å²	31.6	28%	0.279	16%	0.157	S	C	.	.	H	α-helix	trans	-57.2	-38.9	172.3	174.1	0	0	0	0	111.5	W278 Q282 E283 S288 T316 Q322	W278-V286 HydrophobicContact CH2-CG2 3.9Å; W278-V286 HydrophobicContact CZ3-CG2 3.62Å; Q282-V286 PolarHBondContact O-N 2.94Å; E283-V286 WeakPolarHBondContact O-CB 3.24Å; E283-V286 PolarHBondContact O-N 3.31Å; E283-V286 VanDerWaalsContact O-N 3.12Å; V286-S288 PolarHBondContact O-N 3.17Å; V286-T316 HydrophobicContact CG2-CG2 3.38Å; V286-Q322 PolarHBondContact O-NE2 2.75Å
287	R	92.1	Very high	95	Very high	115 Å²	115	29.1 Å²	29.1	43%	0.434	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-6.3	174.5	-53.4	-57.3	166.2	171	-2.4	114.3	E253 E283 T284 V285 N289	E253-R287 PolarHBondContact O-NE 2.94Å; E283-R287 WeakPolarHBondContact O-CG 3.43Å; E283-R287 PolarHBondContact O-N 3.39Å; E283-R287 VanDerWaalsContact O-N 3.1Å; E283-R287 IonicContact OE1-CZ 2.94Å; E283-R287 IonicContact OE1-NE 3.31Å; E283-R287 PolarHBondContact OE1-NE 3.4Å; E283-R287 IonicContact OE1-NH2 2.73Å; E283-R287 PolarHBondContact OE1-NH2 3.36Å; T284-R287 CarbonylContact O-C 3.44Å; T284-R287 PolarHBondContact O-N 2.84Å; V285-R287 PolarHBondContact O-N 2.96Å; R287-N289 PolarHBondContact O-N 3.11Å
288	S	88.9	Confident	95.1	Very high	52 Å²	52	36.4 Å²	36.4	36%	0.364	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.3	26.4	-176.5	-68.8	0	0	0	0	114.9	T284 V285 V286 L290 Q322	T284-S288 PolarHBondContact O-N 2.97Å; V285-S288 WeakPolarHBondContact O-CA 3.4Å; V285-S288 PolarHBondContact O-N 3.49Å; V286-S288 PolarHBondContact O-N 3.17Å; S288-L290 PolarHBondContact O-N 3.04Å; S288-Q322 WeakPolarHBondContact OG-CG 3.39Å; S288-Q322 PolarHBondContact OG-NE2 2.69Å
289	N	93.7	Very high	95.2	Very high	29 Å²	29	36.5 Å²	36.5	16%	0.155	19%	0.186	C	C	.	.			trans	-92.7	100.2	179.8	-169.8	-25.1	0	0	0	111.6	N255 T284 R287 E291 I292 C293	N255-N289 WeakPolarHBondContact OD1-CB 3.35Å; N255-N289 PolarHBondContact OD1-ND2 3.2Å; T284-N289 PolarHBondContact O-N 2.84Å; R287-N289 PolarHBondContact O-N 3.11Å; N289-E291 PolarHBondContact O-N 3.31Å; N289-E291 WeakPolarHBondContact OD1-CB 3.27Å; N289-E291 PolarHBondContact OD1-N 2.66Å; N289-I292 HydrophobicContact CB-CD1 4.27Å; N289-I292 HydrophobicContact CB-CG1 4.31Å; N289-I292 WeakPolarHBondContact ND2-CD1 3.4Å; N289-I292 WeakPolarHBondContact ND2-CG1 3.44Å; N289-I292 PolarHBondContact O-N 2.98Å; N289-I292 PolarHBondContact OD1-N 3.36Å; N289-C293 PolarHBondContact O-N 3.28Å; N289-C293 VanDerWaalsContact O-N 3.09Å; N289-C293 PolarHBondContact O-SG 3.23Å
290	L	95.1	Very high	95.2	Very high	62 Å²	62	38.4 Å²	38.4	33%	0.325	21%	0.206	S	C	.	.	H	α-helix	trans	-69.7	-28.2	-178.9	-56	-171.9	0	0	0	113.8	S288 C293 D294 A324 A325 F328	S288-L290 PolarHBondContact O-N 3.04Å; L290-C293 PolarHBondContact O-N 3.25Å; L290-D294 WeakPolarHBondContact O-CB 3.24Å; L290-D294 PolarHBondContact O-N 3.27Å; L290-A324 HydrophobicContact CD1-CB 4.27Å; L290-A325 HydrophobicContact CD2-CB 4.19Å; L290-F328 HydrophobicContact CB-CD2 4.48Å; L290-F328 HydrophobicContact CD2-CB 3.85Å; L290-F328 HydrophobicContact CD2-CD2 4.42Å; L290-F328 HydrophobicContact CD2-CG 4.05Å
291	E	96.8	Very high	95.2	Very high	119 Å²	119	38.8 Å²	38.8	56%	0.556	21%	0.209	S	C	*	.	H	α-helix	trans	-63.9	-46.5	176.6	-174.5	-170.1	177.3	0	0	110	N289 D294 M295	N289-E291 PolarHBondContact O-N 3.31Å; N289-E291 WeakPolarHBondContact OD1-CB 3.27Å; N289-E291 PolarHBondContact OD1-N 2.66Å; E291-D294 PolarHBondContact O-N 2.86Å; E291-M295 HydrophobicContact CG-CE 4.44Å; E291-M295 WeakPolarHBondContact O-CG 3.39Å; E291-M295 PolarHBondContact O-N 2.85Å
292	I	97.3	Very high	95.2	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-70.1	-36.9	177.2	-49.7	178.3	0	0	0	110.6	A257 V260 T284 N289 D294 M295 L296	A257-I292 HydrophobicContact CB-CD1 4.44Å; A257-I292 HydrophobicContact CB-CG1 4.1Å; V260-I292 HydrophobicContact CB-CG2 4.08Å; V260-I292 HydrophobicContact CG1-CG2 3.81Å; V260-I292 HydrophobicContact CG2-CG2 3.8Å; T284-I292 HydrophobicContact CG2-CB 3.88Å; T284-I292 HydrophobicContact CG2-CG2 3.46Å; T284-I292 VanDerWaalsContact CG2-CG2 3.46Å; N289-I292 HydrophobicContact CB-CD1 4.27Å; N289-I292 HydrophobicContact CB-CG1 4.31Å; N289-I292 WeakPolarHBondContact ND2-CD1 3.4Å; N289-I292 WeakPolarHBondContact ND2-CG1 3.44Å; N289-I292 PolarHBondContact O-N 2.98Å; N289-I292 PolarHBondContact OD1-N 3.36Å; I292-D294 VanDerWaalsContact C-N 3.32Å; I292-D294 PolarHBondContact O-N 3.33Å; I292-M295 HydrophobicContact CB-CE 4.19Å; I292-M295 HydrophobicContact CG1-CE 3.9Å; I292-M295 HydrophobicContact CG2-CE 4.28Å; I292-M295 PolarHBondContact O-N 3.36Å; I292-L296 HydrophobicContact CG2-CD1 4.2Å; I292-L296 HydrophobicContact CG2-CG 4.31Å; I292-L296 WeakPolarHBondContact O-CB 3.33Å; I292-L296 VanDerWaalsContact O-CG 3.23Å; I292-L296 WeakPolarHBondContact O-CG 3.29Å; I292-L296 PolarHBondContact O-N 3.42Å
293	C	96.8	Very high	95.1	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-57.6	-43.8	172.5	-65.1	0	0	0	0	112	L281 T284 N289 L290 L296 L297 F328	L281-C293 HydrophobicContact CD1-CB 4.19Å; T284-C293 PolarHBondContact OG1-SG 3.42Å; T284-C293 VanDerWaalsContact OG1-SG 3.35Å; N289-C293 PolarHBondContact O-N 3.28Å; N289-C293 VanDerWaalsContact O-N 3.09Å; N289-C293 PolarHBondContact O-SG 3.23Å; L290-C293 PolarHBondContact O-N 3.25Å; C293-L296 PolarHBondContact O-N 3.32Å; C293-L297 WeakPolarHBondContact O-CG 3.39Å; C293-L297 PolarHBondContact O-N 3.1Å; C293-F328 HydrophobicContact CB-CD1 4.02Å; C293-F328 HydrophobicContact CB-CE1 3.45Å; C293-F328 VanDerWaalsContact CB-CE1 3.45Å; C293-F328 HydrophobicContact CB-CZ 3.83Å
294	D	97.1	Very high	95.1	Very high	47 Å²	47	48.5 Å²	48.5	25%	0.251	26%	0.255	S	S	.	.	H	α-helix	trans	-66	-43.3	177.9	177.3	71.3	0	0	0	112.5	L290 E291 I292 L296 L297 K298 F328	L290-D294 WeakPolarHBondContact O-CB 3.24Å; L290-D294 PolarHBondContact O-N 3.27Å; E291-D294 PolarHBondContact O-N 2.86Å; I292-D294 VanDerWaalsContact C-N 3.32Å; I292-D294 PolarHBondContact O-N 3.33Å; D294-L296 PolarHBondContact O-N 3Å; D294-L297 PolarHBondContact O-N 3.01Å; D294-K298 WeakPolarHBondContact O-CB 3.44Å; D294-K298 WeakPolarHBondContact O-CG 3.36Å; D294-K298 PolarHBondContact O-N 3.44Å; D294-K298 WeakPolarHBondContact OD1-CE 3.48Å; D294-K298 IonicContact OD1-NZ 3.6Å; D294-K298 WeakPolarHBondContact OD2-CE 3.36Å; D294-K298 IonicContact OD2-NZ 2.63Å; D294-K298 PolarHBondContact OD2-NZ 2.79Å; D294-F328 HydrophobicContact CB-CE2 4.12Å; D294-F328 HydrophobicContact CB-CZ 3.99Å
295	M	97.4	Very high	95	Very high	36 Å²	36	50.4 Å²	50.4	18%	0.177	27%	0.265	C	S	.	.	H	α-helix	trans	-58.5	-45.3	172.7	-71.6	-168.8	-71	0	0	112.3	A257 V260 A261 L264 E291 I292 K298 A299	A257-M295 HydrophobicContact CB-CE 3.8Å; V260-M295 HydrophobicContact CB-CE 4.32Å; V260-M295 HydrophobicContact CG1-CE 4.24Å; A261-M295 HydrophobicContact CB-SD 3.96Å; L264-M295 HydrophobicContact CD1-CB 3.85Å; E291-M295 HydrophobicContact CG-CE 4.44Å; E291-M295 WeakPolarHBondContact O-CG 3.39Å; E291-M295 PolarHBondContact O-N 2.85Å; I292-M295 HydrophobicContact CB-CE 4.19Å; I292-M295 HydrophobicContact CG1-CE 3.9Å; I292-M295 HydrophobicContact CG2-CE 4.28Å; I292-M295 PolarHBondContact O-N 3.36Å; M295-K298 PolarHBondContact O-N 2.98Å; M295-A299 WeakPolarHBondContact O-CB 3.27Å; M295-A299 PolarHBondContact O-N 3.09Å; M295-A299 VanDerWaalsContact O-N 3.08Å
296	L	97.1	Very high	95	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-65.3	-41.2	178.4	-68	172.3	0	0	0	112	L248 V260 L264 V270 A280 L281 T284 I292 C293 D294 A299 G300 A301	L248-L296 HydrophobicContact CD1-CD2 4.12Å; L248-L296 HydrophobicContact CD2-CD2 4.07Å; L248-L296 HydrophobicContact CG-CD2 4.32Å; V260-L296 HydrophobicContact CG1-CD2 4.36Å; L264-L296 HydrophobicContact CD2-CD2 4.38Å; V270-L296 HydrophobicContact CG1-CB 4.27Å; V270-L296 HydrophobicContact CG1-CD2 3.81Å; A280-L296 HydrophobicContact CB-CD1 4.28Å; A280-L296 HydrophobicContact CB-CD2 4.24Å; L281-L296 HydrophobicContact CB-CD1 4.3Å; L281-L296 HydrophobicContact CD1-CD1 4.43Å; T284-L296 HydrophobicContact CG2-CD1 3.57Å; I292-L296 HydrophobicContact CG2-CD1 4.2Å; I292-L296 HydrophobicContact CG2-CG 4.31Å; I292-L296 WeakPolarHBondContact O-CB 3.33Å; I292-L296 VanDerWaalsContact O-CG 3.23Å; I292-L296 WeakPolarHBondContact O-CG 3.29Å; I292-L296 PolarHBondContact O-N 3.42Å; C293-L296 PolarHBondContact O-N 3.32Å; D294-L296 PolarHBondContact O-N 3Å; L296-A299 CarbonylContact O-C 3.59Å; L296-A299 PolarHBondContact O-N 3.14Å; L296-G300 PolarHBondContact O-N 3Å; L296-A301 HydrophobicContact CB-CB 3.95Å; L296-A301 WeakPolarHBondContact O-CB 3.39Å; L296-A301 PolarHBondContact O-N 3.17Å
297	L	96.1	Very high	95.1	Very high	31 Å²	31	53.2 Å²	53.2	16%	0.162	27%	0.271	C	S	.	.	H	α-helix	trans	-65.2	-42.5	176.3	-72.3	-175.9	0	0	0	112.2	L281 C293 D294 A299 G300 A301 L303 F328 H332	L281-L297 HydrophobicContact CD2-CD2 4.18Å; C293-L297 WeakPolarHBondContact O-CG 3.39Å; C293-L297 PolarHBondContact O-N 3.1Å; D294-L297 PolarHBondContact O-N 3.01Å; L297-A299 PolarHBondContact O-N 3.03Å; L297-G300 PolarHBondContact O-N 3.43Å; L297-A301 HydrophobicContact CD2-CB 4.22Å; L297-A301 WeakPolarHBondContact CD2-O 3.31Å; L297-L303 HydrophobicContact CD1-CD2 4.19Å; L297-L303 HydrophobicContact CD2-CD1 4.47Å; L297-L303 HydrophobicContact CD2-CD2 3.69Å; L297-L303 HydrophobicContact CD2-CG 3.79Å; L297-F328 HydrophobicContact CD1-CE1 3.48Å; L297-F328 VanDerWaalsContact CD1-CE1 3.48Å; L297-F328 HydrophobicContact CD1-CZ 3.71Å; L297-F328 HydrophobicContact CG-CE1 4.36Å; L297-H332 HydrophobicContact CD1-CB 3.8Å
298	K	96	Very high	95.3	Very high	161 Å²	161	52.1 Å²	52.1	70%	0.7	27%	0.272	S	S	*	.	H	α-helix	trans	-59.9	-33.5	174.2	-75.2	168.4	176.3	168.8	0	112.5	D294 M295 G300	D294-K298 WeakPolarHBondContact O-CB 3.44Å; D294-K298 WeakPolarHBondContact O-CG 3.36Å; D294-K298 PolarHBondContact O-N 3.44Å; D294-K298 WeakPolarHBondContact OD1-CE 3.48Å; D294-K298 IonicContact OD1-NZ 3.6Å; D294-K298 WeakPolarHBondContact OD2-CE 3.36Å; D294-K298 IonicContact OD2-NZ 2.63Å; D294-K298 PolarHBondContact OD2-NZ 2.79Å; M295-K298 PolarHBondContact O-N 2.98Å; K298-G300 VanDerWaalsContact C-N 3.29Å; K298-G300 PolarHBondContact O-N 2.83Å
299	A	95.9	Very high	95.6	Very high	46 Å²	46	55.8 Å²	55.8	38%	0.38	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	10.3	173.6	0	0	0	0	0	114.3	L264 V270 M295 L296 L297	L264-A299 HydrophobicContact CD1-CB 4.12Å; L264-A299 HydrophobicContact CD2-CB 3.69Å; L264-A299 HydrophobicContact CG-CB 4.36Å; V270-A299 HydrophobicContact CG2-CB 3.69Å; V270-A299 WeakPolarHBondContact CG2-O 3.33Å; M295-A299 WeakPolarHBondContact O-CB 3.27Å; M295-A299 PolarHBondContact O-N 3.09Å; M295-A299 VanDerWaalsContact O-N 3.08Å; L296-A299 CarbonylContact O-C 3.59Å; L296-A299 PolarHBondContact O-N 3.14Å; L297-A299 PolarHBondContact O-N 3.03Å
300	G	95.3	Very high	95.6	Very high	42 Å²	42	54.4 Å²	54.4	43%	0.433	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.5	23.3	171.5	0	0	0	0	0	116	N271 L296 L297 K298 K302	N271-G300 PolarHBondContact ND2-O 3.04Å; L296-G300 PolarHBondContact O-N 3Å; L297-G300 PolarHBondContact O-N 3.43Å; K298-G300 VanDerWaalsContact C-N 3.29Å; K298-G300 PolarHBondContact O-N 2.83Å; G300-K302 PolarHBondContact O-N 3.28Å
301	A	96.2	Very high	95.7	Very high	11 Å²	11	52.8 Å²	52.8	9%	0.091	26%	0.263	C	S	.	.			trans	-60.5	134.3	171	0	0	0	0	0	112.1	V270 L281 L296 L297	V270-A301 HydrophobicContact CG1-CB 3.6Å; L281-A301 HydrophobicContact CB-CB 4.27Å; L281-A301 HydrophobicContact CD2-CB 4.07Å; L296-A301 HydrophobicContact CB-CB 3.95Å; L296-A301 WeakPolarHBondContact O-CB 3.39Å; L296-A301 PolarHBondContact O-N 3.17Å; L297-A301 HydrophobicContact CD2-CB 4.22Å; L297-A301 WeakPolarHBondContact CD2-O 3.31Å
302	K	95.5	Very high	95.7	Very high	131 Å²	131	47.2 Å²	47.2	57%	0.57	24%	0.237	S	C	*	.			trans	-90.8	114.3	179.2	-68.8	175.3	-179.1	-180	0	110.8	N271 G300 N304 L305	N271-K302 WeakPolarHBondContact OD1-CB 3.37Å; N271-K302 PolarHBondContact OD1-N 2.86Å; G300-K302 PolarHBondContact O-N 3.28Å; K302-N304 VanDerWaalsContact C-N 3.29Å; K302-N304 PolarHBondContact O-N 3.49Å; K302-L305 HydrophobicContact CB-CD1 3.79Å; K302-L305 HydrophobicContact CB-CG 3.69Å; K302-L305 HydrophobicContact CD-CD1 4.28Å; K302-L305 HydrophobicContact CD-CD2 4.36Å; K302-L305 HydrophobicContact CD-CG 4.33Å; K302-L305 PolarHBondContact O-N 3.47Å
303	L	93.3	Very high	95.7	Very high	23 Å²	23	47.2 Å²	47.2	12%	0.12	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-33.7	-177.9	-71	160.4	0	0	0	115.2	L281 L297 P313 L329 H332 A334	L281-L303 HydrophobicContact CD2-CD2 4.3Å; L297-L303 HydrophobicContact CD1-CD2 4.19Å; L297-L303 HydrophobicContact CD2-CD1 4.47Å; L297-L303 HydrophobicContact CD2-CD2 3.69Å; L297-L303 HydrophobicContact CD2-CG 3.79Å; L303-P313 VanDerWaalsContact O-CD 3.32Å; L303-P313 WeakPolarHBondContact O-CD 3.33Å; L303-P313 WeakPolarHBondContact O-CG 3.29Å; L303-L329 HydrophobicContact CD2-CD2 3.46Å; L303-L329 VanDerWaalsContact CD2-CD2 3.46Å; L303-H332 HydrophobicContact CD1-CB 3.77Å; L303-H332 WeakPolarHBondContact CD1-O 3.18Å; L303-H332 HydrophobicContact CD2-CB 4.4Å; L303-A334 HydrophobicContact CB-CB 4.25Å; L303-A334 HydrophobicContact CD2-CB 4.47Å
304	N	93.2	Very high	95.7	Very high	68 Å²	68	47.2 Å²	47.2	36%	0.364	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	17.2	-169.7	-61.4	-37.3	0	0	0	113.4	K302 R306 A334 D335	K302-N304 VanDerWaalsContact C-N 3.29Å; K302-N304 PolarHBondContact O-N 3.49Å; N304-R306 PolarHBondContact O-N 3.18Å; N304-A334 WeakPolarHBondContact OD1-CA 3.18Å; N304-D335 PolarHBondContact OD1-N 3.46Å
305	L	93.9	Very high	95.7	Very high	39 Å²	39	45.2 Å²	45.2	20%	0.204	23%	0.226	C	C	.	.			trans	-66.1	130	171.1	-74.3	175.4	0	0	0	110.2	N271 T279 K302 P313	N271-L305 HydrophobicContact CB-CD1 3.94Å; N271-L305 WeakPolarHBondContact OD1-CD1 3.47Å; T279-L305 HydrophobicContact CG2-CB 3.98Å; T279-L305 HydrophobicContact CG2-CD1 3.73Å; K302-L305 HydrophobicContact CB-CD1 3.79Å; K302-L305 HydrophobicContact CB-CG 3.69Å; K302-L305 HydrophobicContact CD-CD1 4.28Å; K302-L305 HydrophobicContact CD-CD2 4.36Å; K302-L305 HydrophobicContact CD-CG 4.33Å; K302-L305 PolarHBondContact O-N 3.47Å; L305-P313 WeakPolarHBondContact O-CD 3.31Å
306	R	94.8	Very high	95.6	Very high	100 Å²	100	43.6 Å²	43.6	38%	0.377	22%	0.219	S	C	.	.			trans	-95.3	141	179	-62.7	-178.2	177	-147.5	-6	110.2	R273 N304 G310 I311 T312 Q339	R273-R306 PolarHBondContact NH1-O 3.24Å; R273-R306 PolarHBondContact NH2-O 2.76Å; N304-R306 PolarHBondContact O-N 3.18Å; R306-G310 WeakPolarHBondContact CD-O 3.25Å; R306-G310 VanDerWaalsContact CG-O 3.29Å; R306-G310 WeakPolarHBondContact CG-O 3.36Å; R306-I311 CarbonylContact C-O 3.49Å; R306-I311 WeakPolarHBondContact CA-O 3.23Å; R306-T312 HydrophobicContact CG-CG2 3.82Å; R306-Q339 PolarHBondContact NH1-O 3.41Å; R306-Q339 PolarHBondContact NH2-O 3.28Å
307	N	94.8	Very high	95.6	Very high	6 Å²	6	43.6 Å²	43.6	3%	0.032	22%	0.219	C	C	.	.			trans	-76.1	-164.7	170.6	74.8	6.9	0	0	0	112.3	R273 G277 W278 Y309 G310 I311	R273-N307 VanDerWaalsContact NH2-C 3.28Å; R273-N307 PolarHBondContact NH2-O 3.38Å; G277-N307 WeakPolarHBondContact O-CA 3.37Å; W278-N307 HydrophobicContact CG-CB 4.38Å; W278-N307 PolarHBondContact NE1-ND2 3.12Å; N307-Y309 PolarHBondContact O-N 3.09Å; N307-Y309 PolarHBondContact OD1-N 2.94Å; N307-G310 PolarHBondContact O-N 3.46Å; N307-I311 PolarHBondContact N-O 3.27Å; N307-I311 WeakPolarHBondContact OD1-CB 3.27Å; N307-I311 PolarHBondContact OD1-N 2.94Å; N307-I311 VanDerWaalsContact OD1-N 3.14Å
308	M	95.9	Very high	95.7	Very high	92 Å²	92	42.1 Å²	42.1	45%	0.453	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-4.3	-179.6	77.2	-174	-8.1	0	0	115.1	I275 Q276	I275-M308 VanDerWaalsContact O-CE 3.24Å; I275-M308 WeakPolarHBondContact O-CE 3.32Å; Q276-M308 VanDerWaalsContact CA-SD 3.58Å; Q276-M308 HydrophobicContact CB-SD 4.07Å; Q276-M308 HydrophobicContact CG-SD 4.39Å; Q276-M308 WeakPolarHBondContact O-CB 3.17Å; Q276-M308 VanDerWaalsContact O-CG 3.27Å; Q276-M308 WeakPolarHBondContact O-CG 3.49Å; Q276-M308 PolarHBondContact O-N 2.71Å; Q276-M308 VanDerWaalsContact O-N 3.14Å
309	Y	94.9	Very high	95.8	Very high	128 Å²	128	37.2 Å²	37.2	50%	0.502	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.6	14.9	178.9	-50.4	-70.8	0	0	0	111.7	N307 I311 D341	N307-Y309 PolarHBondContact O-N 3.09Å; N307-Y309 PolarHBondContact OD1-N 2.94Å; Y309-I311 PolarHBondContact O-N 3.37Å; Y309-D341 WeakPolarHBondContact CA-OD2 3.48Å; Y309-D341 PolarHBondContact O-N 2.77Å
310	G	95.5	Very high	95.8	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.01	19%	0.19	C	C	.	.	S	Bend	trans	77.3	-2.2	-177.1	0	0	0	0	0	114.8	R306 N307 D341	R306-G310 WeakPolarHBondContact CD-O 3.25Å; R306-G310 VanDerWaalsContact CG-O 3.29Å; R306-G310 WeakPolarHBondContact CG-O 3.36Å; N307-G310 PolarHBondContact O-N 3.46Å; G310-D341 VanDerWaalsContact CA-CG 3.49Å; G310-D341 WeakPolarHBondContact CA-OD1 3.41Å; G310-D341 VanDerWaalsContact N-CG 3.28Å; G310-D341 PolarHBondContact N-OD1 2.73Å; G310-D341 PolarHBondContact N-OD2 3.5Å
311	I	96.1	Very high	95.8	Very high	28 Å²	28	37.6 Å²	37.6	14%	0.144	18%	0.182	C	C	.	.			trans	-75.7	128.8	-170.7	-60.9	170.5	0	0	0	110.6	Q282 R306 N307 Y309 F315 T316 A340	Q282-I311 PolarHBondContact NE2-O 2.9Å; R306-I311 CarbonylContact C-O 3.49Å; R306-I311 WeakPolarHBondContact CA-O 3.23Å; N307-I311 PolarHBondContact N-O 3.27Å; N307-I311 WeakPolarHBondContact OD1-CB 3.27Å; N307-I311 PolarHBondContact OD1-N 2.94Å; N307-I311 VanDerWaalsContact OD1-N 3.14Å; Y309-I311 PolarHBondContact O-N 3.37Å; I311-F315 HydrophobicContact CB-CD1 4.43Å; I311-F315 HydrophobicContact CD1-CE1 4.43Å; I311-F315 HydrophobicContact CG1-CD1 4.26Å; I311-F315 HydrophobicContact CG1-CE1 4.27Å; I311-F315 HydrophobicContact CG2-CB 4Å; I311-F315 HydrophobicContact CG2-CD1 3.55Å; I311-F315 HydrophobicContact CG2-CE1 4.31Å; I311-F315 HydrophobicContact CG2-CG 4Å; I311-T316 WeakPolarHBondContact CG2-OG1 3.44Å; I311-A340 HydrophobicContact CG1-CB 4.08Å
312	T	96.6	Very high	95.9	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.006	19%	0.185	C	C	.	.			trans	-94.2	161.2	174.1	58.4	0	0	0	0	112.1	R306 L314 F315 T316 T338	R306-T312 HydrophobicContact CG-CG2 3.82Å; T312-L314 PolarHBondContact O-N 2.9Å; T312-F315 WeakPolarHBondContact O-CB 3.42Å; T312-F315 PolarHBondContact O-N 2.9Å; T312-F315 VanDerWaalsContact O-N 3.11Å; T312-F315 PolarHBondContact OG1-N 3.41Å; T312-T316 PolarHBondContact O-N 3.05Å; T312-T316 PolarHBondContact O-OG1 2.92Å; T312-T338 HydrophobicContact CG2-CG2 4.04Å; T312-T338 PolarHBondContact OG1-OG1 1.86Å
313	P	96.5	Very high	95.9	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-50.1	-39.5	169.5	-28.2	33.1	0	0	0	113.9	L281 Q282 V285 L303 L305 T316 A317 L329	L281-P313 HydrophobicContact CD2-CG 4.31Å; L281-P313 HydrophobicContact CG-CG 4.4Å; Q282-P313 HydrophobicContact CB-CG 4.15Å; Q282-P313 HydrophobicContact CG-CG 4.4Å; V285-P313 HydrophobicContact CG2-CB 4.2Å; L303-P313 VanDerWaalsContact O-CD 3.32Å; L303-P313 WeakPolarHBondContact O-CD 3.33Å; L303-P313 WeakPolarHBondContact O-CG 3.29Å; L305-P313 WeakPolarHBondContact O-CD 3.31Å; P313-T316 PolarHBondContact O-N 3.05Å; P313-A317 PolarHBondContact O-N 3.42Å; P313-L329 HydrophobicContact CB-CD1 4.11Å; P313-L329 HydrophobicContact CB-CD2 4.2Å
314	L	97.6	Very high	96.1	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-66.2	-41.4	178.6	-170.4	77.3	0	0	0	112.2	T312 T316 A317 A318 L326 L329 I330 A334 V336	T312-L314 PolarHBondContact O-N 2.9Å; L314-T316 VanDerWaalsContact C-N 3.34Å; L314-A317 PolarHBondContact O-N 2.76Å; L314-A318 WeakPolarHBondContact O-CB 3.38Å; L314-A318 PolarHBondContact O-N 2.99Å; L314-L326 HydrophobicContact CD1-CD1 3.56Å; L314-L326 HydrophobicContact CD1-CG 4.25Å; L314-L326 HydrophobicContact CG-CD1 4.02Å; L314-L329 HydrophobicContact CB-CD1 4.37Å; L314-L329 HydrophobicContact CD1-CB 3.75Å; L314-L329 HydrophobicContact CD1-CD1 4.2Å; L314-I330 HydrophobicContact CD1-CD1 4.19Å; L314-I330 HydrophobicContact CD1-CG1 3.59Å; L314-I330 HydrophobicContact CD2-CG1 4.38Å; L314-A334 HydrophobicContact CB-CB 4.24Å; L314-A334 HydrophobicContact CD1-CB 4.19Å; L314-A334 HydrophobicContact CD2-CB 4.31Å; L314-A334 HydrophobicContact CG-CB 4.49Å; L314-V336 HydrophobicContact CD2-CB 4.32Å; L314-V336 HydrophobicContact CD2-CG1 4.11Å
315	F	97.4	Very high	96.2	Very high	5 Å²	5	31.6 Å²	31.6	2%	0.022	16%	0.16	C	C	.	.	H	α-helix	trans	-60.3	-45.1	173.3	-176	-70.5	0	0	0	110.8	I311 T312 A317 A318 Q319 A340 A344 E349	I311-F315 HydrophobicContact CB-CD1 4.43Å; I311-F315 HydrophobicContact CD1-CE1 4.43Å; I311-F315 HydrophobicContact CG1-CD1 4.26Å; I311-F315 HydrophobicContact CG1-CE1 4.27Å; I311-F315 HydrophobicContact CG2-CB 4Å; I311-F315 HydrophobicContact CG2-CD1 3.55Å; I311-F315 HydrophobicContact CG2-CE1 4.31Å; I311-F315 HydrophobicContact CG2-CG 4Å; T312-F315 WeakPolarHBondContact O-CB 3.42Å; T312-F315 PolarHBondContact O-N 2.9Å; T312-F315 VanDerWaalsContact O-N 3.11Å; T312-F315 PolarHBondContact OG1-N 3.41Å; F315-A317 PolarHBondContact O-N 2.93Å; F315-A318 PolarHBondContact O-N 3.19Å; F315-Q319 HydrophobicContact CD1-CB 4.48Å; F315-Q319 HydrophobicContact CE1-CB 4.43Å; F315-Q319 WeakPolarHBondContact O-CB 3.41Å; F315-Q319 PolarHBondContact O-N 3.33Å; F315-A340 HydrophobicContact CD2-CB 4.41Å; F315-A340 HydrophobicContact CE2-CB 3.99Å; F315-A340 HydrophobicContact CZ-CB 4.34Å; F315-A344 HydrophobicContact CE2-CB 3.89Å; F315-A344 WeakPolarHBondContact CE2-O 3.37Å; F315-A344 HydrophobicContact CZ-CB 4.23Å; F315-E349 HydrophobicContact CE1-CB 4.04Å; F315-E349 HydrophobicContact CE1-CG 3.78Å; F315-E349 HydrophobicContact CE2-CB 4.01Å; F315-E349 HydrophobicContact CZ-CB 3.62Å; F315-E349 HydrophobicContact CZ-CG 3.72Å
316	T	96.1	Very high	96.4	Very high	3 Å²	3	29.7 Å²	29.7	2%	0.018	15%	0.15	C	C	.	.	H	α-helix	trans	-61.5	-42.4	177.8	-59.4	0	0	0	0	112.1	W278 Q282 V286 I311 T312 P313 L314 A318 Q319 N320	W278-T316 HydrophobicContact CH2-CG2 4.4Å; Q282-T316 PolarHBondContact NE2-OG1 2.87Å; Q282-T316 VanDerWaalsContact NE2-OG1 3.09Å; V286-T316 HydrophobicContact CG2-CG2 3.38Å; I311-T316 WeakPolarHBondContact CG2-OG1 3.44Å; T312-T316 PolarHBondContact O-N 3.05Å; T312-T316 PolarHBondContact O-OG1 2.92Å; P313-T316 PolarHBondContact O-N 3.05Å; L314-T316 VanDerWaalsContact C-N 3.34Å; T316-A318 VanDerWaalsContact C-N 3.33Å; T316-A318 PolarHBondContact O-N 2.69Å; T316-Q319 PolarHBondContact O-N 3.19Å; T316-N320 WeakPolarHBondContact O-CB 3.18Å; T316-N320 PolarHBondContact O-N 2.89Å; T316-N320 VanDerWaalsContact O-N 3.17Å; T316-N320 PolarHBondContact O-ND2 3.38Å
317	A	97.2	Very high	96.5	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-61.3	-41.5	174	0	0	0	0	0	112	V285 P313 L314 F315 G321 Q322 A325 L326 L329	V285-A317 HydrophobicContact CG1-CB 3.75Å; P313-A317 PolarHBondContact O-N 3.42Å; L314-A317 PolarHBondContact O-N 2.76Å; F315-A317 PolarHBondContact O-N 2.93Å; A317-G321 PolarHBondContact O-N 3.05Å; A317-Q322 HydrophobicContact CB-CB 4.38Å; A317-Q322 PolarHBondContact O-N 3.31Å; A317-A325 HydrophobicContact CB-CB 4.25Å; A317-L326 HydrophobicContact CB-CB 4.13Å; A317-L326 HydrophobicContact CB-CD1 3.9Å; A317-L329 HydrophobicContact CB-CD1 4.1Å
318	A	98	Very high	96.6	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-69.1	-42	179.9	0	0	0	0	0	112.7	L314 F315 T316 N320 G321 L326 A346 A350 H355 V358 L362	L314-A318 WeakPolarHBondContact O-CB 3.38Å; L314-A318 PolarHBondContact O-N 2.99Å; F315-A318 PolarHBondContact O-N 3.19Å; T316-A318 VanDerWaalsContact C-N 3.33Å; T316-A318 PolarHBondContact O-N 2.69Å; A318-N320 VanDerWaalsContact C-N 3.31Å; A318-N320 PolarHBondContact O-N 3.36Å; A318-G321 PolarHBondContact O-N 3.49Å; A318-L326 HydrophobicContact CB-CD1 3.9Å; A318-A346 HydrophobicContact CB-CB 3.77Å; A318-A346 WeakPolarHBondContact CB-O 3.32Å; A318-A350 HydrophobicContact CB-CB 4.38Å; A318-H355 PolarHBondContact O-CD2 3.35Å; A318-H355 VanDerWaalsContact O-CD2 3.28Å; A318-V358 HydrophobicContact CB-CG1 3.9Å; A318-L362 HydrophobicContact CB-CD1 4.13Å
319	Q	96.4	Very high	96.7	Very high	57 Å²	57	27.7 Å²	27.7	27%	0.266	14%	0.138	S	C	.	.	H	α-helix	trans	-60.1	-39.5	176.2	-178.9	172.8	59.6	0	0	112.4	F315 T316 E349 H355	F315-Q319 HydrophobicContact CD1-CB 4.48Å; F315-Q319 HydrophobicContact CE1-CB 4.43Å; F315-Q319 WeakPolarHBondContact O-CB 3.41Å; F315-Q319 PolarHBondContact O-N 3.33Å; T316-Q319 PolarHBondContact O-N 3.19Å; Q319-E349 HydrophobicContact CB-CG 3.72Å; Q319-E349 HydrophobicContact CG-CG 3.68Å; Q319-E349 PolarHBondContact NE2-OE1 2.76Å; Q319-H355 PolarHBondContact O-CD2 2.85Å; Q319-H355 PolarHBondContact O-NE2 3.31Å
320	N	96.1	Very high	96.8	Very high	71 Å²	71	22.7 Å²	22.7	38%	0.38	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	2.5	-177.8	-66.9	-32.8	0	0	0	114.1	T316 A318 Q322	T316-N320 WeakPolarHBondContact O-CB 3.18Å; T316-N320 PolarHBondContact O-N 2.89Å; T316-N320 VanDerWaalsContact O-N 3.17Å; T316-N320 PolarHBondContact O-ND2 3.38Å; A318-N320 VanDerWaalsContact C-N 3.31Å; A318-N320 PolarHBondContact O-N 3.36Å; N320-Q322 HydrophobicContact CB-CG 3.71Å; N320-Q322 PolarHBondContact O-N 2.93Å
321	G	96.8	Very high	96.8	Very high	25 Å²	25	31 Å²	31	26%	0.258	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.6	16.6	-178.5	0	0	0	0	0	114.3	A317 A318 M323 H355	A317-G321 PolarHBondContact O-N 3.05Å; A318-G321 PolarHBondContact O-N 3.49Å; G321-M323 VanDerWaalsContact C-N 3.26Å; G321-M323 PolarHBondContact O-N 3.21Å; G321-H355 PolarHBondContact N-CD2 3.45Å; G321-H355 PolarHBondContact N-NE2 3.05Å
322	Q	96.6	Very high	96.9	Very high	32 Å²	32	33.5 Å²	33.5	15%	0.15	17%	0.166	C	C	.	.			trans	-80.6	68.4	-168.7	-68	172.3	-34.3	0	0	112	V285 V286 S288 A317 N320 A324 A325 L326	V285-Q322 PolarHBondContact O-NE2 2.92Å; V285-Q322 PolarHBondContact O-OE1 3.37Å; V286-Q322 PolarHBondContact O-NE2 2.75Å; S288-Q322 WeakPolarHBondContact OG-CG 3.39Å; S288-Q322 PolarHBondContact OG-NE2 2.69Å; A317-Q322 HydrophobicContact CB-CB 4.38Å; A317-Q322 PolarHBondContact O-N 3.31Å; N320-Q322 HydrophobicContact CB-CG 3.71Å; N320-Q322 PolarHBondContact O-N 2.93Å; Q322-A324 PolarHBondContact O-N 2.9Å; Q322-A324 VanDerWaalsContact O-N 3.11Å; Q322-A325 HydrophobicContact CB-CB 4.21Å; Q322-A325 PolarHBondContact O-N 3.04Å; Q322-L326 WeakPolarHBondContact O-CB 3.39Å; Q322-L326 PolarHBondContact O-N 3Å
323	M	96.9	Very high	96.8	Very high	24 Å²	24	35.9 Å²	35.9	12%	0.118	19%	0.192	C	C	.	.	H	α-helix	trans	-54.9	-32.4	-172.4	-172.4	63.3	157.7	0	0	114.4	G321 L326 R327 E357 V358 M361	G321-M323 VanDerWaalsContact C-N 3.26Å; G321-M323 PolarHBondContact O-N 3.21Å; M323-L326 HydrophobicContact SD-CD2 4.29Å; M323-R327 VanDerWaalsContact CE-NH1 3.32Å; M323-R327 VanDerWaalsContact CG-CZ 3.44Å; M323-R327 WeakPolarHBondContact O-CB 3.47Å; M323-R327 WeakPolarHBondContact O-CG 3.46Å; M323-R327 PolarHBondContact O-N 3.04Å; M323-E357 HydrophobicContact CE-CB 3.9Å; M323-E357 WeakPolarHBondContact CE-O 3.15Å; M323-E357 HydrophobicContact SD-CB 4.32Å; M323-V358 HydrophobicContact CB-CG2 4.44Å; M323-V358 HydrophobicContact SD-CG2 4.18Å; M323-M361 HydrophobicContact CE-CB 3.6Å; M323-M361 HydrophobicContact CE-CG 3.92Å; M323-M361 HydrophobicContact SD-CB 4.02Å; M323-M361 HydrophobicContact SD-CG 4.36Å
324	A	96.4	Very high	96.8	Very high	50 Å²	50	36.2 Å²	36.2	41%	0.413	19%	0.194	S	C	.	.	H	α-helix	trans	-68.6	-48.6	175.6	0	0	0	0	0	112.5	L290 Q322 L326 R327 F328	L290-A324 HydrophobicContact CD1-CB 4.27Å; Q322-A324 PolarHBondContact O-N 2.9Å; Q322-A324 VanDerWaalsContact O-N 3.11Å; A324-L326 VanDerWaalsContact C-N 3.35Å; A324-R327 PolarHBondContact O-N 3.04Å; A324-F328 WeakPolarHBondContact O-CB 3.41Å; A324-F328 PolarHBondContact O-N 3.31Å
325	A	96.5	Very high	96.7	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.008	21%	0.214	C	C	.	.	H	α-helix	trans	-64.9	-39.6	175.2	0	0	0	0	0	111.5	V285 L290 A317 Q322 F328 L329	V285-A325 HydrophobicContact CG1-CB 4.15Å; L290-A325 HydrophobicContact CD2-CB 4.19Å; A317-A325 HydrophobicContact CB-CB 4.25Å; Q322-A325 HydrophobicContact CB-CB 4.21Å; Q322-A325 PolarHBondContact O-N 3.04Å; A325-F328 WeakPolarHBondContact O-CB 3.5Å; A325-F328 PolarHBondContact O-N 3.48Å; A325-L329 WeakPolarHBondContact O-CB 3.43Å; A325-L329 VanDerWaalsContact O-CG 3.23Å; A325-L329 WeakPolarHBondContact O-CG 3.21Å; A325-L329 PolarHBondContact O-N 2.93Å
326	L	97.4	Very high	96.7	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-59.9	-49.4	176.8	-165.4	77.8	0	0	0	112.1	L314 A317 A318 Q322 M323 A324 F328 L329 I330 V358 M361 L362	L314-L326 HydrophobicContact CD1-CD1 3.56Å; L314-L326 HydrophobicContact CD1-CG 4.25Å; L314-L326 HydrophobicContact CG-CD1 4.02Å; A317-L326 HydrophobicContact CB-CB 4.13Å; A317-L326 HydrophobicContact CB-CD1 3.9Å; A318-L326 HydrophobicContact CB-CD1 3.9Å; Q322-L326 WeakPolarHBondContact O-CB 3.39Å; Q322-L326 PolarHBondContact O-N 3Å; M323-L326 HydrophobicContact SD-CD2 4.29Å; A324-L326 VanDerWaalsContact C-N 3.35Å; L326-F328 VanDerWaalsContact C-N 3.33Å; L326-F328 PolarHBondContact O-N 3.27Å; L326-L329 PolarHBondContact O-N 3.36Å; L326-I330 WeakPolarHBondContact O-CG1 3.36Å; L326-I330 PolarHBondContact O-N 3.38Å; L326-I330 VanDerWaalsContact O-N 3.11Å; L326-V358 HydrophobicContact CD2-CB 4.01Å; L326-V358 HydrophobicContact CD2-CG1 3.61Å; L326-V358 HydrophobicContact CD2-CG2 3.82Å; L326-M361 HydrophobicContact CB-CE 4.1Å; L326-M361 HydrophobicContact CD2-CE 3.3Å; L326-M361 HydrophobicContact CG-CE 3.43Å; L326-M361 VanDerWaalsContact CG-CE 3.43Å; L326-L362 HydrophobicContact CD1-CD2 4.43Å; L326-L362 HydrophobicContact CD2-CG 4.33Å
327	R	97.2	Very high	96.7	Very high	128 Å²	128	42.4 Å²	42.4	48%	0.483	23%	0.228	S	C	.	.	H	α-helix	trans	-60.3	-41.8	174	-78.2	-173.2	-75.9	-118.8	1.3	112.1	M323 A324 K331 M361	M323-R327 VanDerWaalsContact CE-NH1 3.32Å; M323-R327 VanDerWaalsContact CG-CZ 3.44Å; M323-R327 WeakPolarHBondContact O-CB 3.47Å; M323-R327 WeakPolarHBondContact O-CG 3.46Å; M323-R327 PolarHBondContact O-N 3.04Å; A324-R327 PolarHBondContact O-N 3.04Å; R327-K331 WeakPolarHBondContact O-CB 3.21Å; R327-K331 PolarHBondContact O-N 3.44Å; R327-M361 HydrophobicContact CG-CE 4.13Å; R327-M361 HydrophobicContact CG-CG 4.43Å; R327-M361 HydrophobicContact CG-SD 4.45Å
328	F	96.8	Very high	96.6	Very high	27 Å²	27	42.8 Å²	42.8	12%	0.118	23%	0.23	C	C	.	.	H	α-helix	trans	-61.6	-47.1	177.8	177.2	-86.3	0	0	0	112.2	L290 C293 D294 L297 A324 A325 L326 K331 H332	L290-F328 HydrophobicContact CB-CD2 4.48Å; L290-F328 HydrophobicContact CD2-CB 3.85Å; L290-F328 HydrophobicContact CD2-CD2 4.42Å; L290-F328 HydrophobicContact CD2-CG 4.05Å; C293-F328 HydrophobicContact CB-CD1 4.02Å; C293-F328 HydrophobicContact CB-CE1 3.45Å; C293-F328 VanDerWaalsContact CB-CE1 3.45Å; C293-F328 HydrophobicContact CB-CZ 3.83Å; D294-F328 HydrophobicContact CB-CE2 4.12Å; D294-F328 HydrophobicContact CB-CZ 3.99Å; L297-F328 HydrophobicContact CD1-CE1 3.48Å; L297-F328 VanDerWaalsContact CD1-CE1 3.48Å; L297-F328 HydrophobicContact CD1-CZ 3.71Å; L297-F328 HydrophobicContact CG-CE1 4.36Å; A324-F328 WeakPolarHBondContact O-CB 3.41Å; A324-F328 PolarHBondContact O-N 3.31Å; A325-F328 WeakPolarHBondContact O-CB 3.5Å; A325-F328 PolarHBondContact O-N 3.48Å; L326-F328 VanDerWaalsContact C-N 3.33Å; L326-F328 PolarHBondContact O-N 3.27Å; F328-K331 PolarHBondContact O-N 3.06Å; F328-H332 AromaticContact CD2-CE1 3.8Å; F328-H332 AromaticContact CE1-ND1 3.82Å; F328-H332 AromaticContact CE2-CE1 3.39Å; F328-H332 WeakPolarHBondContact CE2-CE1 3.5Å; F328-H332 AromaticContact CE2-ND1 3.93Å; F328-H332 AromaticContact CZ-CE1 3.52Å; F328-H332 AromaticContact CZ-ND1 3.77Å; F328-H332 PolarHBondContact O-N 3.17Å; F328-H332 PolarHBondContact O-ND1 3.42Å
329	L	97.2	Very high	96.5	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-64.8	-44.3	-179.3	-69.7	167.8	0	0	0	111.9	V285 L303 P313 L314 A317 A325 L326 H332 G333 A334	V285-L329 HydrophobicContact CG1-CD1 4.29Å; V285-L329 HydrophobicContact CG2-CD1 3.95Å; V285-L329 HydrophobicContact CG2-CD2 4.2Å; V285-L329 HydrophobicContact CG2-CG 4.41Å; L303-L329 HydrophobicContact CD2-CD2 3.46Å; L303-L329 VanDerWaalsContact CD2-CD2 3.46Å; P313-L329 HydrophobicContact CB-CD1 4.11Å; P313-L329 HydrophobicContact CB-CD2 4.2Å; L314-L329 HydrophobicContact CB-CD1 4.37Å; L314-L329 HydrophobicContact CD1-CB 3.75Å; L314-L329 HydrophobicContact CD1-CD1 4.2Å; A317-L329 HydrophobicContact CB-CD1 4.1Å; A325-L329 WeakPolarHBondContact O-CB 3.43Å; A325-L329 VanDerWaalsContact O-CG 3.23Å; A325-L329 WeakPolarHBondContact O-CG 3.21Å; A325-L329 PolarHBondContact O-N 2.93Å; L326-L329 PolarHBondContact O-N 3.36Å; L329-H332 PolarHBondContact O-N 3.25Å; L329-G333 PolarHBondContact O-N 3.03Å; L329-A334 HydrophobicContact CB-CB 3.91Å; L329-A334 VanDerWaalsContact O-CB 3.25Å; L329-A334 WeakPolarHBondContact O-CB 3.12Å; L329-A334 PolarHBondContact O-N 2.94Å
330	I	97.1	Very high	96.5	Very high	24 Å²	24	42.9 Å²	42.9	12%	0.123	23%	0.232	C	C	.	.	H	α-helix	trans	-65.3	-41.9	177.7	-65.1	-178.2	0	0	0	111.2	L314 L326 H332 G333 V336 M361 L362 Q365	L314-I330 HydrophobicContact CD1-CD1 4.19Å; L314-I330 HydrophobicContact CD1-CG1 3.59Å; L314-I330 HydrophobicContact CD2-CG1 4.38Å; L326-I330 WeakPolarHBondContact O-CG1 3.36Å; L326-I330 PolarHBondContact O-N 3.38Å; L326-I330 VanDerWaalsContact O-N 3.11Å; I330-H332 PolarHBondContact O-N 2.91Å; I330-H332 VanDerWaalsContact O-N 3.11Å; I330-G333 PolarHBondContact O-N 3.27Å; I330-V336 HydrophobicContact CD1-CG1 3.65Å; I330-V336 HydrophobicContact CG1-CG1 3.96Å; I330-M361 HydrophobicContact CD1-CE 3.54Å; I330-M361 HydrophobicContact CD1-SD 3.81Å; I330-L362 HydrophobicContact CD1-CD2 4.14Å; I330-Q365 HydrophobicContact CD1-CB 4.33Å; I330-Q365 HydrophobicContact CD1-CG 4Å; I330-Q365 HydrophobicContact CG2-CG 4.03Å
331	K	97.1	Very high	96.4	Very high	176 Å²	176	44.8 Å²	44.8	77%	0.765	24%	0.242	S	C	*	.	H	α-helix	trans	-55.4	-30.4	176.2	-179.6	180	174.4	-173.1	0	112.7	R327 F328	R327-K331 WeakPolarHBondContact O-CB 3.21Å; R327-K331 PolarHBondContact O-N 3.44Å; F328-K331 PolarHBondContact O-N 3.06Å
332	H	96.4	Very high	96.3	Very high	79 Å²	79	46.9 Å²	46.9	37%	0.366	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	4.3	178	-64.7	94.9	0	0	0	114.3	L297 L303 F328 L329 I330	L297-H332 HydrophobicContact CD1-CB 3.8Å; L303-H332 HydrophobicContact CD1-CB 3.77Å; L303-H332 WeakPolarHBondContact CD1-O 3.18Å; L303-H332 HydrophobicContact CD2-CB 4.4Å; F328-H332 AromaticContact CD2-CE1 3.8Å; F328-H332 AromaticContact CE1-ND1 3.82Å; F328-H332 AromaticContact CE2-CE1 3.39Å; F328-H332 WeakPolarHBondContact CE2-CE1 3.5Å; F328-H332 AromaticContact CE2-ND1 3.93Å; F328-H332 AromaticContact CZ-CE1 3.52Å; F328-H332 AromaticContact CZ-ND1 3.77Å; F328-H332 PolarHBondContact O-N 3.17Å; F328-H332 PolarHBondContact O-ND1 3.42Å; L329-H332 PolarHBondContact O-N 3.25Å; I330-H332 PolarHBondContact O-N 2.91Å; I330-H332 VanDerWaalsContact O-N 3.11Å
333	G	95.5	Very high	96.2	Very high	52 Å²	52	46.2 Å²	46.2	54%	0.536	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	93.9	27.1	174.5	0	0	0	0	0	115.7	L329 I330	L329-G333 PolarHBondContact O-N 3.03Å; I330-G333 PolarHBondContact O-N 3.27Å
334	A	96.5	Very high	96.2	Very high	7 Å²	7	45.1 Å²	45.1	6%	0.058	24%	0.244	C	C	.	.			trans	-64	137.9	168.2	0	0	0	0	0	111.2	L303 N304 L314 L329 V336	L303-A334 HydrophobicContact CB-CB 4.25Å; L303-A334 HydrophobicContact CD2-CB 4.47Å; N304-A334 WeakPolarHBondContact OD1-CA 3.18Å; L314-A334 HydrophobicContact CB-CB 4.24Å; L314-A334 HydrophobicContact CD1-CB 4.19Å; L314-A334 HydrophobicContact CD2-CB 4.31Å; L314-A334 HydrophobicContact CG-CB 4.49Å; L329-A334 HydrophobicContact CB-CB 3.91Å; L329-A334 VanDerWaalsContact O-CB 3.25Å; L329-A334 WeakPolarHBondContact O-CB 3.12Å; L329-A334 PolarHBondContact O-N 2.94Å; A334-V336 PolarHBondContact O-N 3.38Å
335	D	95.8	Very high	96.3	Very high	75 Å²	75	42.8 Å²	42.8	40%	0.401	23%	0.225	S	C	.	.			trans	-81	110.2	-178	170.9	18.9	0	0	0	111.4	N304 N337 T338	N304-D335 PolarHBondContact OD1-N 3.46Å; D335-N337 PolarHBondContact O-N 2.86Å; D335-N337 PolarHBondContact OD1-N 2.95Å; D335-T338 HydrophobicContact CB-CG2 3.8Å; D335-T338 WeakPolarHBondContact O-CG2 3.24Å; D335-T338 PolarHBondContact O-N 3.01Å; D335-T338 PolarHBondContact O-OG1 2.92Å; D335-T338 WeakPolarHBondContact OD2-CG2 3.18Å
336	V	96.9	Very high	96.3	Very high	15 Å²	15	42.8 Å²	42.8	9%	0.091	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-19.8	-179.7	-57.4	0	0	0	0	114.4	L314 I330 A334 L362 Q365 A367	L314-V336 HydrophobicContact CD2-CB 4.32Å; L314-V336 HydrophobicContact CD2-CG1 4.11Å; I330-V336 HydrophobicContact CD1-CG1 3.65Å; I330-V336 HydrophobicContact CG1-CG1 3.96Å; A334-V336 PolarHBondContact O-N 3.38Å; V336-L362 HydrophobicContact CG1-CD2 4.49Å; V336-Q365 HydrophobicContact CG1-CB 4.14Å; V336-A367 HydrophobicContact CB-CB 4.45Å; V336-A367 HydrophobicContact CG2-CB 4.44Å
337	N	95.8	Very high	96.4	Very high	47 Å²	47	42.8 Å²	42.8	25%	0.251	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	10.4	-176	-74.2	-51	0	0	0	113.4	D335 K366 D368	D335-N337 PolarHBondContact O-N 2.86Å; D335-N337 PolarHBondContact OD1-N 2.95Å; N337-K366 PolarHBondContact ND2-O 3.02Å; N337-D368 WeakPolarHBondContact OD1-CB 3.38Å; N337-D368 PolarHBondContact OD1-N 3.26Å
338	T	95.2	Very high	96.4	Very high	8 Å²	8	37.4 Å²	37.4	5%	0.049	20%	0.204	C	C	.	.			trans	-58	142.2	169.2	49.1	0	0	0	0	111.5	T312 D335	T312-T338 HydrophobicContact CG2-CG2 4.04Å; T312-T338 PolarHBondContact OG1-OG1 1.86Å; D335-T338 HydrophobicContact CB-CG2 3.8Å; D335-T338 WeakPolarHBondContact O-CG2 3.24Å; D335-T338 PolarHBondContact O-N 3.01Å; D335-T338 PolarHBondContact O-OG1 2.92Å; D335-T338 WeakPolarHBondContact OD2-CG2 3.18Å
339	Q	95.1	Very high	96.5	Very high	53 Å²	53	36.4 Å²	36.4	25%	0.248	20%	0.2	C	C	.	.	B	Isolated β-bridge	trans	-119.9	134.2	-179.3	-70.6	178	-100.4	0	0	109.4	R306 G343 A344 T345 K371	R306-Q339 PolarHBondContact NH1-O 3.41Å; R306-Q339 PolarHBondContact NH2-O 3.28Å; Q339-G343 WeakPolarHBondContact CG-O 3.27Å; Q339-G343 PolarHBondContact NE2-O 2.88Å; Q339-A344 CarbonylContact C-O 3.53Å; Q339-A344 VanDerWaalsContact CA-O 3.28Å; Q339-A344 WeakPolarHBondContact CA-O 3.33Å; Q339-T345 HydrophobicContact CG-CG2 3.68Å; Q339-K371 HydrophobicContact CG-CD 4.12Å
340	A	96.6	Very high	96.5	Very high	7 Å²	7	36.4 Å²	36.4	6%	0.058	20%	0.2	C	C	.	.			trans	-63.7	171.1	165.9	0	0	0	0	0	110.9	I311 F315 D342 G343 A344	I311-A340 HydrophobicContact CG1-CB 4.08Å; F315-A340 HydrophobicContact CD2-CB 4.41Å; F315-A340 HydrophobicContact CE2-CB 3.99Å; F315-A340 HydrophobicContact CZ-CB 4.34Å; A340-D342 WeakPolarHBondContact CB-OD1 3.24Å; A340-D342 PolarHBondContact O-N 3.06Å; A340-G343 WeakPolarHBondContact O-CA 3.24Å; A340-G343 PolarHBondContact O-N 2.73Å; A340-A344 PolarHBondContact N-O 2.96Å
341	D	95.6	Very high	96.6	Very high	111 Å²	111	35.2 Å²	35.2	59%	0.594	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-16	-176.4	-63.5	-20.7	0	0	0	112.5	Y309 G310 G343	Y309-D341 WeakPolarHBondContact CA-OD2 3.48Å; Y309-D341 PolarHBondContact O-N 2.77Å; G310-D341 VanDerWaalsContact CA-CG 3.49Å; G310-D341 WeakPolarHBondContact CA-OD1 3.41Å; G310-D341 VanDerWaalsContact N-CG 3.28Å; G310-D341 PolarHBondContact N-OD1 2.73Å; G310-D341 PolarHBondContact N-OD2 3.5Å; D341-G343 VanDerWaalsContact C-N 3.25Å
342	D	93.8	Very high	96.5	Very high	68 Å²	68	29.6 Å²	29.6	36%	0.364	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	4.1	168.3	85.3	-25.8	0	0	0	113	A340 A344 G373 K374	A340-D342 WeakPolarHBondContact CB-OD1 3.24Å; A340-D342 PolarHBondContact O-N 3.06Å; D342-A344 VanDerWaalsContact C-N 3.31Å; D342-A344 PolarHBondContact O-N 3.46Å; D342-A344 WeakPolarHBondContact OD1-CB 3.28Å; D342-A344 PolarHBondContact OD1-N 3.27Å; D342-G373 CarbonylContact O-C 3.55Å; D342-K374 HydrophobicContact CB-CB 4.1Å; D342-K374 HydrophobicContact CB-CD 4.26Å; D342-K374 WeakPolarHBondContact O-CA 3.35Å; D342-K374 VanDerWaalsContact O-CB 3.27Å; D342-K374 WeakPolarHBondContact O-CB 3.26Å; D342-K374 PolarHBondContact O-N 3.47Å
343	G	94.9	Very high	96.6	Very high	19 Å²	19	29.7 Å²	29.7	20%	0.196	17%	0.171	C	C	.	.	S	Bend	trans	82.8	-10.6	-178.7	0	0	0	0	0	115.4	Q339 A340 D341	Q339-G343 WeakPolarHBondContact CG-O 3.27Å; Q339-G343 PolarHBondContact NE2-O 2.88Å; A340-G343 WeakPolarHBondContact O-CA 3.24Å; A340-G343 PolarHBondContact O-N 2.73Å; D341-G343 VanDerWaalsContact C-N 3.25Å
344	A	96.6	Very high	96.7	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.162	C	C	.	.			trans	-64.6	137.8	-178.6	0	0	0	0	0	112.1	F315 Q339 A340 D342 Y348	F315-A344 HydrophobicContact CE2-CB 3.89Å; F315-A344 WeakPolarHBondContact CE2-O 3.37Å; F315-A344 HydrophobicContact CZ-CB 4.23Å; Q339-A344 CarbonylContact C-O 3.53Å; Q339-A344 VanDerWaalsContact CA-O 3.28Å; Q339-A344 WeakPolarHBondContact CA-O 3.33Å; A340-A344 PolarHBondContact N-O 2.96Å; D342-A344 VanDerWaalsContact C-N 3.31Å; D342-A344 PolarHBondContact O-N 3.46Å; D342-A344 WeakPolarHBondContact OD1-CB 3.28Å; D342-A344 PolarHBondContact OD1-N 3.27Å; A344-Y348 HydrophobicContact CB-CD1 3.57Å; A344-Y348 HydrophobicContact CB-CE1 4.08Å; A344-Y348 HydrophobicContact CB-CG 4.2Å
345	T	97.8	Very high	96.8	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.012	17%	0.172	C	C	.	.	B	Isolated β-bridge	trans	-91.1	166.8	169.5	58.1	0	0	0	0	111.5	Q339 L347 Y348 E349 K371	Q339-T345 HydrophobicContact CG-CG2 3.68Å; T345-L347 PolarHBondContact O-N 2.99Å; T345-Y348 WeakPolarHBondContact O-CB 3.22Å; T345-Y348 PolarHBondContact O-N 3.31Å; T345-Y348 VanDerWaalsContact O-N 3.14Å; T345-Y348 PolarHBondContact OG1-N 3.44Å; T345-Y348 VanDerWaalsContact OG1-N 3.09Å; T345-E349 PolarHBondContact O-N 2.74Å; T345-K371 HydrophobicContact CG2-CB 3.71Å; T345-K371 HydrophobicContact CG2-CD 3.5Å; T345-K371 VanDerWaalsContact CG2-CD 3.5Å; T345-K371 HydrophobicContact CG2-CG 4.23Å
346	A	98	Very high	96.9	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-53.5	-38.8	168.4	0	0	0	0	0	112.3	A318 A350 L362	A318-A346 HydrophobicContact CB-CB 3.77Å; A318-A346 WeakPolarHBondContact CB-O 3.32Å; A346-A350 VanDerWaalsContact O-CB 3.31Å; A346-A350 WeakPolarHBondContact O-CB 3.49Å; A346-A350 PolarHBondContact O-N 2.71Å; A346-L362 HydrophobicContact CB-CD1 4.08Å; A346-L362 HydrophobicContact CB-CD2 4.38Å
347	L	98.5	Very high	96.9	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-66.3	-42.1	176.7	177.8	65.6	0	0	0	112.3	T345 A351 V359 L362 L363 A367 A369 P379 L395	T345-L347 PolarHBondContact O-N 2.99Å; L347-A351 WeakPolarHBondContact O-CB 3.4Å; L347-A351 PolarHBondContact O-N 3.4Å; L347-V359 HydrophobicContact CD1-CB 4.4Å; L347-V359 HydrophobicContact CD1-CG1 3.94Å; L347-V359 HydrophobicContact CD1-CG2 4.4Å; L347-L362 HydrophobicContact CB-CD1 4.33Å; L347-L362 HydrophobicContact CD1-CB 4.18Å; L347-L363 HydrophobicContact CD1-CD2 4Å; L347-L363 HydrophobicContact CD1-CG 4Å; L347-L363 HydrophobicContact CD2-CD2 3.71Å; L347-A367 HydrophobicContact CB-CB 4.15Å; L347-A367 HydrophobicContact CD2-CB 4.05Å; L347-A369 HydrophobicContact CD2-CB 4.02Å; L347-P379 HydrophobicContact CD2-CG 4.41Å; L347-P379 HydrophobicContact CG-CB 4.49Å; L347-P379 HydrophobicContact CG-CG 4.3Å; L347-L395 HydrophobicContact CD1-CD2 4.38Å; L347-L395 HydrophobicContact CD2-CD2 4.33Å
348	Y	98.1	Very high	97.1	Very high	15 Å²	15	35.3 Å²	35.3	6%	0.059	19%	0.186	C	C	.	.	H	α-helix	trans	-61.3	-47.8	176.3	179.8	-85	0	0	0	111.5	A344 T345 A351 K352 M377 P379 I382	A344-Y348 HydrophobicContact CB-CD1 3.57Å; A344-Y348 HydrophobicContact CB-CE1 4.08Å; A344-Y348 HydrophobicContact CB-CG 4.2Å; T345-Y348 WeakPolarHBondContact O-CB 3.22Å; T345-Y348 PolarHBondContact O-N 3.31Å; T345-Y348 VanDerWaalsContact O-N 3.14Å; T345-Y348 PolarHBondContact OG1-N 3.44Å; T345-Y348 VanDerWaalsContact OG1-N 3.09Å; Y348-A351 PolarHBondContact O-N 3.35Å; Y348-K352 HydrophobicContact CE1-CD 4.13Å; Y348-K352 WeakPolarHBondContact O-CB 3.48Å; Y348-K352 PolarHBondContact O-N 2.99Å; Y348-M377 WeakPolarHBondContact CE2-O 3.21Å; Y348-P379 HydrophobicContact CD2-CG 4.21Å; Y348-I382 HydrophobicContact CD2-CG1 4.36Å; Y348-I382 HydrophobicContact CE1-CG1 4.48Å; Y348-I382 HydrophobicContact CE2-CD1 4.31Å; Y348-I382 HydrophobicContact CE2-CG1 3.55Å; Y348-I382 WeakPolarHBondContact OH-CD1 3.42Å
349	E	97.4	Very high	97.2	Very high	6 Å²	6	34.9 Å²	34.9	3%	0.028	18%	0.184	C	C	.	.	H	α-helix	trans	-71.3	-35.9	-177.3	-163.3	67.8	-177.3	0	0	111.9	F315 Q319 T345 K352 M353	F315-E349 HydrophobicContact CE1-CB 4.04Å; F315-E349 HydrophobicContact CE1-CG 3.78Å; F315-E349 HydrophobicContact CE2-CB 4.01Å; F315-E349 HydrophobicContact CZ-CB 3.62Å; F315-E349 HydrophobicContact CZ-CG 3.72Å; Q319-E349 HydrophobicContact CB-CG 3.72Å; Q319-E349 HydrophobicContact CG-CG 3.68Å; Q319-E349 PolarHBondContact NE2-OE1 2.76Å; T345-E349 PolarHBondContact O-N 2.74Å; E349-K352 WeakPolarHBondContact O-CB 3.36Å; E349-K352 PolarHBondContact O-N 3.07Å; E349-K352 IonicContact OE1-NZ 3.16Å; E349-K352 PolarHBondContact OE1-NZ 3.13Å; E349-K352 WeakPolarHBondContact OE2-CD 3.33Å; E349-K352 IonicContact OE2-NZ 2.92Å; E349-K352 PolarHBondContact OE2-NZ 3.25Å; E349-M353 WeakPolarHBondContact O-CG 3.46Å; E349-M353 PolarHBondContact O-N 2.91Å; E349-M353 WeakPolarHBondContact OE1-CE 3.41Å
350	A	98.3	Very high	97.4	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-61.1	-44.9	171.6	0	0	0	0	0	112.6	A318 A346 K352 M353 G354 H355 V358 V359 L362	A318-A350 HydrophobicContact CB-CB 4.38Å; A346-A350 VanDerWaalsContact O-CB 3.31Å; A346-A350 WeakPolarHBondContact O-CB 3.49Å; A346-A350 PolarHBondContact O-N 2.71Å; A350-K352 VanDerWaalsContact C-N 3.32Å; A350-K352 PolarHBondContact O-N 3.02Å; A350-M353 PolarHBondContact O-N 2.75Å; A350-G354 PolarHBondContact O-N 2.88Å; A350-H355 PolarHBondContact O-N 3.03Å; A350-V358 HydrophobicContact CB-CB 4.29Å; A350-V358 HydrophobicContact CB-CG1 3.38Å; A350-V359 HydrophobicContact CB-CG2 3.84Å; A350-L362 HydrophobicContact CB-CD1 4.34Å
351	A	98.1	Very high	97.5	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-63.2	-38.4	175	0	0	0	0	0	111.9	L347 Y348 M353 G354 V359 P379 I391 L395	L347-A351 WeakPolarHBondContact O-CB 3.4Å; L347-A351 PolarHBondContact O-N 3.4Å; Y348-A351 PolarHBondContact O-N 3.35Å; A351-M353 VanDerWaalsContact C-N 3.31Å; A351-M353 PolarHBondContact O-N 3.31Å; A351-G354 PolarHBondContact O-N 3.19Å; A351-V359 HydrophobicContact CB-CG2 4.27Å; A351-P379 HydrophobicContact CB-CB 4.2Å; A351-I391 HydrophobicContact CB-CG2 3.9Å; A351-L395 HydrophobicContact CB-CD1 4.29Å
352	K	96.7	Very high	97.6	Very high	57 Å²	57	33.3 Å²	33.3	25%	0.248	17%	0.172	C	C	.	.	H	α-helix	trans	-65.6	-29.1	176.6	-178.9	173.2	141	-141.3	0	114.3	Y348 E349 A350 I382 R386	Y348-K352 HydrophobicContact CE1-CD 4.13Å; Y348-K352 WeakPolarHBondContact O-CB 3.48Å; Y348-K352 PolarHBondContact O-N 2.99Å; E349-K352 WeakPolarHBondContact O-CB 3.36Å; E349-K352 PolarHBondContact O-N 3.07Å; E349-K352 IonicContact OE1-NZ 3.16Å; E349-K352 PolarHBondContact OE1-NZ 3.13Å; E349-K352 WeakPolarHBondContact OE2-CD 3.33Å; E349-K352 IonicContact OE2-NZ 2.92Å; E349-K352 PolarHBondContact OE2-NZ 3.25Å; A350-K352 VanDerWaalsContact C-N 3.32Å; A350-K352 PolarHBondContact O-N 3.02Å; K352-I382 HydrophobicContact CB-CG2 3.71Å; K352-I382 HydrophobicContact CG-CG2 3.98Å; K352-R386 PolarHBondContact O-NE 3.05Å; K352-R386 PolarHBondContact O-NH2 2.84Å
353	M	97.4	Very high	97.8	Very high	81 Å²	81	31.6 Å²	31.6	40%	0.399	16%	0.163	S	C	.	.	H	α-helix	trans	-98.2	-4.6	179.3	-61.2	-55.8	168.7	0	0	113.8	E349 A350 A351 H355	E349-M353 WeakPolarHBondContact O-CG 3.46Å; E349-M353 PolarHBondContact O-N 2.91Å; E349-M353 WeakPolarHBondContact OE1-CE 3.41Å; A350-M353 PolarHBondContact O-N 2.75Å; A351-M353 VanDerWaalsContact C-N 3.31Å; A351-M353 PolarHBondContact O-N 3.31Å; M353-H355 WeakPolarHBondContact CB-NE2 3.08Å
354	G	97.2	Very high	98	Very high	34 Å²	34	34.3 Å²	34.3	35%	0.351	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.6	14.7	176.6	0	0	0	0	0	115.1	A350 A351 Q356	A350-G354 PolarHBondContact O-N 2.88Å; A351-G354 PolarHBondContact O-N 3.19Å; G354-Q356 PolarHBondContact O-N 2.91Å
355	H	98.2	Very high	98	Very high	56 Å²	56	38.6 Å²	38.6	26%	0.259	20%	0.199	S	C	.	.			trans	-79.6	79.5	-174.3	-61.7	-49.9	0	0	0	112.1	A318 Q319 G321 A350 M353 E357 V358 V359	A318-H355 PolarHBondContact O-CD2 3.35Å; A318-H355 VanDerWaalsContact O-CD2 3.28Å; Q319-H355 PolarHBondContact O-CD2 2.85Å; Q319-H355 PolarHBondContact O-NE2 3.31Å; G321-H355 PolarHBondContact N-CD2 3.45Å; G321-H355 PolarHBondContact N-NE2 3.05Å; A350-H355 PolarHBondContact O-N 3.03Å; M353-H355 WeakPolarHBondContact CB-NE2 3.08Å; H355-E357 PolarHBondContact O-N 3.09Å; H355-V358 HydrophobicContact CB-CB 3.85Å; H355-V358 HydrophobicContact CB-CG1 4.47Å; H355-V358 HydrophobicContact CB-CG2 4.14Å; H355-V358 WeakPolarHBondContact O-CB 3.36Å; H355-V358 PolarHBondContact O-N 3.38Å; H355-V358 VanDerWaalsContact O-N 3.17Å; H355-V359 PolarHBondContact O-N 2.94Å
356	Q	98.1	Very high	98	Very high	103 Å²	103	47.2 Å²	47.2	48%	0.481	24%	0.236	S	C	.	.	H	α-helix	trans	-52.9	-51.1	-173.7	-174.7	-174.7	-24.6	0	0	113.9	G354 V358 V359 Q360 A390 I391 M394	G354-Q356 PolarHBondContact O-N 2.91Å; Q356-V358 VanDerWaalsContact C-N 3.3Å; Q356-V358 PolarHBondContact O-N 3.38Å; Q356-V359 PolarHBondContact O-N 3.12Å; Q356-Q360 PolarHBondContact O-N 3.35Å; Q356-A390 HydrophobicContact CG-CB 4.04Å; Q356-I391 HydrophobicContact CB-CG1 4.31Å; Q356-I391 HydrophobicContact CG-CG1 4.5Å; Q356-M394 HydrophobicContact CG-CE 3.63Å
357	E	98.2	Very high	98	Very high	118 Å²	118	47.6 Å²	47.6	55%	0.551	24%	0.239	S	C	*	.	H	α-helix	trans	-60.2	-40.4	-179.9	-66.2	-171.9	-167.2	0	0	112.2	M323 H355 Q360 M361	M323-E357 HydrophobicContact CE-CB 3.9Å; M323-E357 WeakPolarHBondContact CE-O 3.15Å; M323-E357 HydrophobicContact SD-CB 4.32Å; H355-E357 PolarHBondContact O-N 3.09Å; E357-Q360 PolarHBondContact O-N 3.45Å; E357-M361 WeakPolarHBondContact O-CB 3.33Å; E357-M361 PolarHBondContact O-N 2.98Å
358	V	98.6	Very high	97.9	Very high	3 Å²	3	50.2 Å²	50.2	2%	0.018	25%	0.253	C	S	.	.	H	α-helix	trans	-63.9	-44.6	177.4	163	0	0	0	0	110.7	A318 M323 L326 A350 H355 Q356 M361 L362	A318-V358 HydrophobicContact CB-CG1 3.9Å; M323-V358 HydrophobicContact CB-CG2 4.44Å; M323-V358 HydrophobicContact SD-CG2 4.18Å; L326-V358 HydrophobicContact CD2-CB 4.01Å; L326-V358 HydrophobicContact CD2-CG1 3.61Å; L326-V358 HydrophobicContact CD2-CG2 3.82Å; A350-V358 HydrophobicContact CB-CB 4.29Å; A350-V358 HydrophobicContact CB-CG1 3.38Å; H355-V358 HydrophobicContact CB-CB 3.85Å; H355-V358 HydrophobicContact CB-CG1 4.47Å; H355-V358 HydrophobicContact CB-CG2 4.14Å; H355-V358 WeakPolarHBondContact O-CB 3.36Å; H355-V358 PolarHBondContact O-N 3.38Å; H355-V358 VanDerWaalsContact O-N 3.17Å; Q356-V358 VanDerWaalsContact C-N 3.3Å; Q356-V358 PolarHBondContact O-N 3.38Å; V358-M361 PolarHBondContact O-N 3.24Å; V358-L362 HydrophobicContact CG1-CD1 3.81Å; V358-L362 HydrophobicContact CG1-CG 4.48Å; V358-L362 WeakPolarHBondContact O-CB 3.48Å; V358-L362 VanDerWaalsContact O-CG 3.29Å; V358-L362 WeakPolarHBondContact O-CG 3.36Å; V358-L362 PolarHBondContact O-N 2.97Å
359	V	98.6	Very high	97.9	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-58.8	-51	174.1	169.1	0	0	0	0	110.4	L347 A350 A351 H355 Q356 M361 L362 L363 I391 M394	L347-V359 HydrophobicContact CD1-CB 4.4Å; L347-V359 HydrophobicContact CD1-CG1 3.94Å; L347-V359 HydrophobicContact CD1-CG2 4.4Å; A350-V359 HydrophobicContact CB-CG2 3.84Å; A351-V359 HydrophobicContact CB-CG2 4.27Å; H355-V359 PolarHBondContact O-N 2.94Å; Q356-V359 PolarHBondContact O-N 3.12Å; V359-M361 VanDerWaalsContact C-N 3.28Å; V359-M361 PolarHBondContact O-N 3.3Å; V359-L362 PolarHBondContact O-N 3.38Å; V359-L363 HydrophobicContact CG1-CD1 3.85Å; V359-L363 HydrophobicContact CG1-CG 4.35Å; V359-L363 WeakPolarHBondContact O-CB 3.08Å; V359-L363 VanDerWaalsContact O-CG 3.32Å; V359-L363 WeakPolarHBondContact O-CG 3.4Å; V359-L363 PolarHBondContact O-N 3.47Å; V359-I391 HydrophobicContact CG1-CG2 4.25Å; V359-I391 HydrophobicContact CG2-CD1 4.2Å; V359-I391 HydrophobicContact CG2-CG1 4.39Å; V359-I391 HydrophobicContact CG2-CG2 4.23Å; V359-M394 HydrophobicContact CB-CE 4.11Å; V359-M394 HydrophobicContact CG1-CE 3.79Å
360	Q	98.4	Very high	97.9	Very high	115 Å²	115	50.8 Å²	50.8	54%	0.537	26%	0.258	S	S	.	.	H	α-helix	trans	-55.9	-44.4	180	-167.4	-178	27.1	0	0	111.6	Q356 E357 L363 S364 M394	Q356-Q360 PolarHBondContact O-N 3.35Å; E357-Q360 PolarHBondContact O-N 3.45Å; Q360-L363 PolarHBondContact O-N 3.12Å; Q360-S364 PolarHBondContact O-N 3.39Å; Q360-M394 HydrophobicContact CB-CE 4.28Å; Q360-M394 HydrophobicContact CB-SD 3.54Å; Q360-M394 VanDerWaalsContact CB-SD 3.54Å; Q360-M394 HydrophobicContact CG-SD 3.75Å
361	M	98.4	Very high	97.7	Very high	23 Å²	23	53.2 Å²	53.2	11%	0.113	27%	0.268	C	S	.	.	H	α-helix	trans	-70.3	-45	-179.2	-159.2	-80.5	-65.2	0	0	111.7	M323 L326 R327 I330 E357 V358 V359 L363 S364 Q365	M323-M361 HydrophobicContact CE-CB 3.6Å; M323-M361 HydrophobicContact CE-CG 3.92Å; M323-M361 HydrophobicContact SD-CB 4.02Å; M323-M361 HydrophobicContact SD-CG 4.36Å; L326-M361 HydrophobicContact CB-CE 4.1Å; L326-M361 HydrophobicContact CD2-CE 3.3Å; L326-M361 HydrophobicContact CG-CE 3.43Å; L326-M361 VanDerWaalsContact CG-CE 3.43Å; R327-M361 HydrophobicContact CG-CE 4.13Å; R327-M361 HydrophobicContact CG-CG 4.43Å; R327-M361 HydrophobicContact CG-SD 4.45Å; I330-M361 HydrophobicContact CD1-CE 3.54Å; I330-M361 HydrophobicContact CD1-SD 3.81Å; E357-M361 WeakPolarHBondContact O-CB 3.33Å; E357-M361 PolarHBondContact O-N 2.98Å; V358-M361 PolarHBondContact O-N 3.24Å; V359-M361 VanDerWaalsContact C-N 3.28Å; V359-M361 PolarHBondContact O-N 3.3Å; M361-L363 VanDerWaalsContact C-N 3.29Å; M361-L363 PolarHBondContact O-N 3.49Å; M361-S364 WeakPolarHBondContact O-CB 3.38Å; M361-S364 PolarHBondContact O-N 3.47Å; M361-S364 VanDerWaalsContact O-N 3.09Å; M361-S364 PolarHBondContact O-OG 2.87Å; M361-Q365 WeakPolarHBondContact O-CG 3.27Å; M361-Q365 PolarHBondContact O-N 2.88Å; M361-Q365 VanDerWaalsContact O-N 3.09Å; M361-Q365 HydrophobicContact SD-CG 3.71Å
362	L	98.6	Very high	97.5	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-58.7	-40.4	175.1	-73.2	169.7	0	0	0	112.1	A318 L326 I330 V336 A346 L347 A350 V358 V359 Q365 K366 A367	A318-L362 HydrophobicContact CB-CD1 4.13Å; L326-L362 HydrophobicContact CD1-CD2 4.43Å; L326-L362 HydrophobicContact CD2-CG 4.33Å; I330-L362 HydrophobicContact CD1-CD2 4.14Å; V336-L362 HydrophobicContact CG1-CD2 4.49Å; A346-L362 HydrophobicContact CB-CD1 4.08Å; A346-L362 HydrophobicContact CB-CD2 4.38Å; L347-L362 HydrophobicContact CB-CD1 4.33Å; L347-L362 HydrophobicContact CD1-CB 4.18Å; A350-L362 HydrophobicContact CB-CD1 4.34Å; V358-L362 HydrophobicContact CG1-CD1 3.81Å; V358-L362 HydrophobicContact CG1-CG 4.48Å; V358-L362 WeakPolarHBondContact O-CB 3.48Å; V358-L362 VanDerWaalsContact O-CG 3.29Å; V358-L362 WeakPolarHBondContact O-CG 3.36Å; V358-L362 PolarHBondContact O-N 2.97Å; V359-L362 PolarHBondContact O-N 3.38Å; L362-Q365 CarbonylContact O-C 3.51Å; L362-Q365 PolarHBondContact O-N 3.21Å; L362-Q365 VanDerWaalsContact O-N 3.16Å; L362-K366 PolarHBondContact O-N 3.02Å; L362-A367 HydrophobicContact CB-CB 3.94Å; L362-A367 WeakPolarHBondContact O-CB 3.15Å; L362-A367 PolarHBondContact O-N 3.34Å
363	L	98.4	Very high	97.3	Very high	31 Å²	31	53.3 Å²	53.3	16%	0.162	28%	0.276	C	S	.	.	H	α-helix	trans	-65.2	-40.4	174	-68.5	177.2	0	0	0	112.3	L347 V359 Q360 M361 Q365 K366 M394 L395 V398	L347-L363 HydrophobicContact CD1-CD2 4Å; L347-L363 HydrophobicContact CD1-CG 4Å; L347-L363 HydrophobicContact CD2-CD2 3.71Å; V359-L363 HydrophobicContact CG1-CD1 3.85Å; V359-L363 HydrophobicContact CG1-CG 4.35Å; V359-L363 WeakPolarHBondContact O-CB 3.08Å; V359-L363 VanDerWaalsContact O-CG 3.32Å; V359-L363 WeakPolarHBondContact O-CG 3.4Å; V359-L363 PolarHBondContact O-N 3.47Å; Q360-L363 PolarHBondContact O-N 3.12Å; M361-L363 VanDerWaalsContact C-N 3.29Å; M361-L363 PolarHBondContact O-N 3.49Å; L363-Q365 PolarHBondContact O-N 3.1Å; L363-Q365 VanDerWaalsContact O-N 3.17Å; L363-K366 PolarHBondContact O-N 3.49Å; L363-M394 HydrophobicContact CD1-CB 3.94Å; L363-L395 HydrophobicContact CD1-CD2 4.14Å; L363-L395 HydrophobicContact CD2-CD2 4.25Å; L363-V398 HydrophobicContact CD1-CG2 4.45Å; L363-V398 HydrophobicContact CD2-CG2 3.9Å
364	S	97.8	Very high	97	Very high	76 Å²	76	57.9 Å²	57.9	53%	0.531	29%	0.293	S	S	.	.	H	α-helix	trans	-59	-27.1	173.1	83.2	0	0	0	0	113	Q360 M361	Q360-S364 PolarHBondContact O-N 3.39Å; M361-S364 WeakPolarHBondContact O-CB 3.38Å; M361-S364 PolarHBondContact O-N 3.47Å; M361-S364 VanDerWaalsContact O-N 3.09Å; M361-S364 PolarHBondContact O-OG 2.87Å
365	Q	97.8	Very high	96.6	Very high	90 Å²	90	59.7 Å²	59.7	42%	0.421	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	16.9	177.7	-56.6	-57.8	-53.7	0	0	113	I330 V336 M361 L362 L363 A367	I330-Q365 HydrophobicContact CD1-CB 4.33Å; I330-Q365 HydrophobicContact CD1-CG 4Å; I330-Q365 HydrophobicContact CG2-CG 4.03Å; V336-Q365 HydrophobicContact CG1-CB 4.14Å; M361-Q365 WeakPolarHBondContact O-CG 3.27Å; M361-Q365 PolarHBondContact O-N 2.88Å; M361-Q365 VanDerWaalsContact O-N 3.09Å; M361-Q365 HydrophobicContact SD-CG 3.71Å; L362-Q365 CarbonylContact O-C 3.51Å; L362-Q365 PolarHBondContact O-N 3.21Å; L362-Q365 VanDerWaalsContact O-N 3.16Å; L363-Q365 PolarHBondContact O-N 3.1Å; L363-Q365 VanDerWaalsContact O-N 3.17Å; Q365-A367 PolarHBondContact O-N 3.13Å
366	K	96.4	Very high	96.4	Very high	183 Å²	183	58.4 Å²	58.4	80%	0.796	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	36.5	177	-51.9	177.5	-178.6	177.2	0	114	N337 L362 L363	N337-K366 PolarHBondContact ND2-O 3.02Å; L362-K366 PolarHBondContact O-N 3.02Å; L363-K366 PolarHBondContact O-N 3.49Å
367	A	97.9	Very high	96.3	Very high	8 Å²	8	54.6 Å²	54.6	7%	0.066	28%	0.282	C	S	.	.			trans	-62.6	135.2	166.8	0	0	0	0	0	110.9	V336 L347 L362 Q365 A369	V336-A367 HydrophobicContact CB-CB 4.45Å; V336-A367 HydrophobicContact CG2-CB 4.44Å; L347-A367 HydrophobicContact CB-CB 4.15Å; L347-A367 HydrophobicContact CD2-CB 4.05Å; L362-A367 HydrophobicContact CB-CB 3.94Å; L362-A367 WeakPolarHBondContact O-CB 3.15Å; L362-A367 PolarHBondContact O-N 3.34Å; Q365-A367 PolarHBondContact O-N 3.13Å; A367-A369 PolarHBondContact O-N 2.9Å
368	D	97.6	Very high	96.3	Very high	56 Å²	56	49 Å²	49	30%	0.299	26%	0.256	S	S	.	.			trans	-80.9	105.3	-174	-176.5	11.2	0	0	0	112	N337 N370 K371	N337-D368 WeakPolarHBondContact OD1-CB 3.38Å; N337-D368 PolarHBondContact OD1-N 3.26Å; D368-N370 PolarHBondContact O-N 3.03Å; D368-N370 VanDerWaalsContact O-N 3.14Å; D368-N370 WeakPolarHBondContact OD1-CA 3.42Å; D368-N370 WeakPolarHBondContact OD1-CB 3.49Å; D368-N370 PolarHBondContact OD1-N 3.21Å; D368-N370 PolarHBondContact OD1-ND2 2.93Å; D368-K371 HydrophobicContact CB-CD 4.19Å; D368-K371 HydrophobicContact CB-CG 4.29Å; D368-K371 PolarHBondContact O-N 3.45Å
369	A	97.6	Very high	96.3	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.008	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-3.5	173.6	0	0	0	0	0	114.2	L347 A367 P379 L395 V398	L347-A369 HydrophobicContact CD2-CB 4.02Å; A367-A369 PolarHBondContact O-N 2.9Å; A369-P379 WeakPolarHBondContact O-CD 3.29Å; A369-L395 HydrophobicContact CB-CD2 4.01Å; A369-V398 HydrophobicContact CB-CB 4.27Å; A369-V398 HydrophobicContact CB-CG2 3.67Å
370	N	97.1	Very high	96.3	Very high	31 Å²	31	48.9 Å²	48.9	17%	0.166	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104	2.9	-176.1	-54.9	-87.7	0	0	0	113.6	D368 L378 V398 S400 R403	D368-N370 PolarHBondContact O-N 3.03Å; D368-N370 VanDerWaalsContact O-N 3.14Å; D368-N370 WeakPolarHBondContact OD1-CA 3.42Å; D368-N370 WeakPolarHBondContact OD1-CB 3.49Å; D368-N370 PolarHBondContact OD1-N 3.21Å; D368-N370 PolarHBondContact OD1-ND2 2.93Å; N370-L378 WeakPolarHBondContact O-CD2 3.36Å; N370-V398 PolarHBondContact ND2-O 3.5Å; N370-S400 WeakPolarHBondContact OD1-CB 3.34Å; N370-S400 PolarHBondContact OD1-N 3.24Å; N370-R403 HydrophobicContact CB-CB 4.48Å; N370-R403 HydrophobicContact CB-CG 4.16Å
371	K	95.1	Very high	96.3	Very high	52 Å²	52	43.4 Å²	43.4	23%	0.226	23%	0.229	C	C	.	.			trans	-80.9	120.6	171.1	-77.9	174.5	175.7	-66.3	0	110.6	Q339 T345 D368	Q339-K371 HydrophobicContact CG-CD 4.12Å; T345-K371 HydrophobicContact CG2-CB 3.71Å; T345-K371 HydrophobicContact CG2-CD 3.5Å; T345-K371 VanDerWaalsContact CG2-CD 3.5Å; T345-K371 HydrophobicContact CG2-CG 4.23Å; D368-K371 HydrophobicContact CB-CD 4.19Å; D368-K371 HydrophobicContact CB-CG 4.29Å; D368-K371 PolarHBondContact O-N 3.45Å
372	P	93.7	Very high	96.2	Very high	52 Å²	52	42.6 Å²	42.6	34%	0.338	23%	0.226	S	C	.	.			trans	-81.8	150.9	176.6	33.2	-34.3	0	0	0	112.2	M377 L378	P372-M377 CarbonylContact C-O 3.48Å; P372-M377 WeakPolarHBondContact CA-O 3.31Å; P372-L378 HydrophobicContact CB-CD2 4.04Å
373	G	91.8	Very high	96.2	Very high	6 Å²	6	42.6 Å²	42.6	6%	0.062	23%	0.226	C	C	.	.			trans	-81.7	-176.1	160.8	0	0	0	0	0	112.5	D342 T375 G376 M377	D342-G373 CarbonylContact O-C 3.55Å; G373-T375 PolarHBondContact O-N 3.47Å; G373-G376 PolarHBondContact O-N 3.02Å; G373-M377 PolarHBondContact N-O 2.8Å
374	K	92.1	Very high	96.2	Very high	178 Å²	178	41.1 Å²	41.1	77%	0.774	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51	-32	-171.9	-168.9	173.4	177.5	178.4	0	115.5	D342 G376	D342-K374 HydrophobicContact CB-CB 4.1Å; D342-K374 HydrophobicContact CB-CD 4.26Å; D342-K374 WeakPolarHBondContact O-CA 3.35Å; D342-K374 VanDerWaalsContact O-CB 3.27Å; D342-K374 WeakPolarHBondContact O-CB 3.26Å; D342-K374 PolarHBondContact O-N 3.47Å; K374-G376 VanDerWaalsContact C-N 3.26Å; K374-G376 PolarHBondContact O-N 3.23Å
375	T	89.4	Confident	96.2	Very high	72 Å²	72	39.9 Å²	39.9	44%	0.442	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	5.1	-178.2	53.6	0	0	0	0	113.7	G373 M377 R442	G373-T375 PolarHBondContact O-N 3.47Å; T375-M377 HydrophobicContact CG2-CE 4.23Å; T375-M377 PolarHBondContact O-N 3.29Å; T375-M377 VanDerWaalsContact OG1-CE 3.27Å; T375-M377 WeakPolarHBondContact OG1-CE 3.48Å; T375-R442 PolarHBondContact O-NH2 3.4Å
376	G	92.6	Very high	96.1	Very high	29 Å²	29	41.4 Å²	41.4	30%	0.299	21%	0.206	S	C	.	.	S	Bend	trans	74	0.6	-171.5	0	0	0	0	0	114.1	G373 K374 T407	G373-G376 PolarHBondContact O-N 3.02Å; K374-G376 VanDerWaalsContact C-N 3.26Å; K374-G376 PolarHBondContact O-N 3.23Å; G376-T407 WeakPolarHBondContact O-CG2 3.32Å
377	M	96.1	Very high	96	Very high	23 Å²	23	33.9 Å²	33.9	11%	0.113	18%	0.18	C	C	.	.			trans	-80.3	141.8	-178.8	-68.5	-164.3	-77.9	0	0	112	Y348 P372 G373 T375 H381 I382 L414	Y348-M377 WeakPolarHBondContact CE2-O 3.21Å; P372-M377 CarbonylContact C-O 3.48Å; P372-M377 WeakPolarHBondContact CA-O 3.31Å; G373-M377 PolarHBondContact N-O 2.8Å; T375-M377 HydrophobicContact CG2-CE 4.23Å; T375-M377 PolarHBondContact O-N 3.29Å; T375-M377 VanDerWaalsContact OG1-CE 3.27Å; T375-M377 WeakPolarHBondContact OG1-CE 3.48Å; M377-H381 HydrophobicContact CB-CB 3.96Å; M377-H381 HydrophobicContact CG-CB 4.22Å; M377-H381 HydrophobicContact SD-CB 4.22Å; M377-I382 HydrophobicContact CB-CD1 4.2Å; M377-I382 HydrophobicContact CE-CD1 3.53Å; M377-I382 HydrophobicContact SD-CD1 3.94Å; M377-L414 HydrophobicContact SD-CD1 3.91Å
378	L	98	Very high	95.9	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.185	C	C	.	.			trans	-87.3	165	172.7	-50.1	177.3	0	0	0	110.4	N370 P372 L380 H381 I382 T399 R403 V404 T407	N370-L378 WeakPolarHBondContact O-CD2 3.36Å; P372-L378 HydrophobicContact CB-CD2 4.04Å; L378-L380 PolarHBondContact O-N 2.97Å; L378-L380 VanDerWaalsContact O-N 3.17Å; L378-H381 WeakPolarHBondContact CB-ND1 3.42Å; L378-H381 WeakPolarHBondContact CD1-CE1 3.48Å; L378-H381 WeakPolarHBondContact CG-CE1 3.46Å; L378-H381 PolarHBondContact N-ND1 2.98Å; L378-H381 WeakPolarHBondContact O-CB 3.48Å; L378-H381 PolarHBondContact O-N 3.01Å; L378-I382 PolarHBondContact O-N 3.05Å; L378-T399 HydrophobicContact CD1-CG2 3.83Å; L378-R403 HydrophobicContact CD1-CB 4.17Å; L378-R403 HydrophobicContact CD1-CG 3.67Å; L378-R403 HydrophobicContact CD2-CG 3.74Å; L378-R403 HydrophobicContact CG-CG 4.3Å; L378-V404 HydrophobicContact CD1-CG2 3.78Å; L378-T407 HydrophobicContact CG-CG2 4.19Å
379	P	98.3	Very high	95.9	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-49.3	-39.5	172	-28	34.7	0	0	0	113.7	L347 Y348 A351 A369 H381 I382 A383 L395	L347-P379 HydrophobicContact CD2-CG 4.41Å; L347-P379 HydrophobicContact CG-CB 4.49Å; L347-P379 HydrophobicContact CG-CG 4.3Å; Y348-P379 HydrophobicContact CD2-CG 4.21Å; A351-P379 HydrophobicContact CB-CB 4.2Å; A369-P379 WeakPolarHBondContact O-CD 3.29Å; P379-H381 PolarHBondContact O-N 3.15Å; P379-I382 PolarHBondContact O-N 3.09Å; P379-A383 WeakPolarHBondContact O-CB 3.48Å; P379-A383 PolarHBondContact O-N 2.88Å; P379-L395 HydrophobicContact CB-CD1 3.85Å; P379-L395 HydrophobicContact CB-CD2 4.18Å
380	L	98.6	Very high	95.9	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-62.9	-38.5	179.2	-179.2	63.2	0	0	0	112.8	L378 I382 A383 A384 V392 L395 I396 T399 P411 L427 F432	L378-L380 PolarHBondContact O-N 2.97Å; L378-L380 VanDerWaalsContact O-N 3.17Å; L380-I382 VanDerWaalsContact C-N 3.33Å; L380-I382 PolarHBondContact O-N 3.49Å; L380-A383 PolarHBondContact O-N 3.02Å; L380-A384 WeakPolarHBondContact O-CB 3.32Å; L380-A384 PolarHBondContact O-N 3.34Å; L380-V392 HydrophobicContact CD1-CB 4.48Å; L380-V392 HydrophobicContact CD1-CG1 4.11Å; L380-L395 HydrophobicContact CB-CB 4.26Å; L380-L395 HydrophobicContact CD1-CB 3.88Å; L380-I396 HydrophobicContact CD1-CG1 4.1Å; L380-T399 HydrophobicContact CB-CG2 4.18Å; L380-T399 HydrophobicContact CD2-CG2 3.83Å; L380-P411 HydrophobicContact CD2-CG 4.08Å; L380-P411 HydrophobicContact CG-CB 4.49Å; L380-P411 HydrophobicContact CG-CG 4.05Å; L380-L427 HydrophobicContact CD1-CD2 4.46Å; L380-F432 HydrophobicContact CD2-CE1 4.05Å; L380-F432 HydrophobicContact CD2-CE2 4.46Å; L380-F432 HydrophobicContact CD2-CZ 3.55Å
381	H	98.4	Very high	95.9	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62	-43	176.2	-65.8	93.9	0	0	0	111.4	M377 L378 P379 A384 Q385 V404 T407 I409 L414	M377-H381 HydrophobicContact CB-CB 3.96Å; M377-H381 HydrophobicContact CG-CB 4.22Å; M377-H381 HydrophobicContact SD-CB 4.22Å; L378-H381 WeakPolarHBondContact CB-ND1 3.42Å; L378-H381 WeakPolarHBondContact CD1-CE1 3.48Å; L378-H381 WeakPolarHBondContact CG-CE1 3.46Å; L378-H381 PolarHBondContact N-ND1 2.98Å; L378-H381 WeakPolarHBondContact O-CB 3.48Å; L378-H381 PolarHBondContact O-N 3.01Å; P379-H381 PolarHBondContact O-N 3.15Å; H381-A384 PolarHBondContact O-N 3.39Å; H381-Q385 WeakPolarHBondContact O-CB 3.35Å; H381-Q385 PolarHBondContact O-N 3.49Å; H381-V404 WeakPolarHBondContact CE1-CA 3.45Å; H381-V404 VanDerWaalsContact CE1-CG2 3.49Å; H381-V404 WeakPolarHBondContact CE1-CG2 3.38Å; H381-V404 WeakPolarHBondContact NE2-CG1 3.32Å; H381-T407 WeakPolarHBondContact CE1-CG2 3.43Å; H381-T407 PolarHBondContact NE2-OG1 2.91Å; H381-I409 PolarHBondContact CD2-O 2.88Å; H381-I409 PolarHBondContact NE2-O 3.15Å; H381-L414 HydrophobicContact CB-CD1 3.66Å; H381-L414 WeakPolarHBondContact O-CD1 3.33Å
382	I	97.6	Very high	96.1	Very high	7 Å²	7	33 Å²	33	4%	0.036	18%	0.182	C	C	.	.	H	α-helix	trans	-70.8	-43.1	179.4	-57.1	-59.1	0	0	0	111.2	Y348 K352 M377 L378 P379 L380 A384 Q385 R386	Y348-I382 HydrophobicContact CD2-CG1 4.36Å; Y348-I382 HydrophobicContact CE1-CG1 4.48Å; Y348-I382 HydrophobicContact CE2-CD1 4.31Å; Y348-I382 HydrophobicContact CE2-CG1 3.55Å; Y348-I382 WeakPolarHBondContact OH-CD1 3.42Å; K352-I382 HydrophobicContact CB-CG2 3.71Å; K352-I382 HydrophobicContact CG-CG2 3.98Å; M377-I382 HydrophobicContact CB-CD1 4.2Å; M377-I382 HydrophobicContact CE-CD1 3.53Å; M377-I382 HydrophobicContact SD-CD1 3.94Å; L378-I382 PolarHBondContact O-N 3.05Å; P379-I382 PolarHBondContact O-N 3.09Å; L380-I382 VanDerWaalsContact C-N 3.33Å; L380-I382 PolarHBondContact O-N 3.49Å; I382-A384 VanDerWaalsContact C-N 3.27Å; I382-A384 PolarHBondContact O-N 3.19Å; I382-Q385 PolarHBondContact O-N 2.92Å; I382-R386 HydrophobicContact CG2-CG 4.28Å; I382-R386 WeakPolarHBondContact O-CB 3.44Å; I382-R386 VanDerWaalsContact O-CG 3.32Å; I382-R386 WeakPolarHBondContact O-CG 3.46Å; I382-R386 PolarHBondContact O-N 2.94Å
383	A	98	Very high	96.3	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-57.9	-41.8	175.3	0	0	0	0	0	111.6	P379 L380 R386 G387 S388 I391 V392 L395	P379-A383 WeakPolarHBondContact O-CB 3.48Å; P379-A383 PolarHBondContact O-N 2.88Å; L380-A383 PolarHBondContact O-N 3.02Å; A383-R386 PolarHBondContact O-N 2.9Å; A383-G387 PolarHBondContact O-N 3.04Å; A383-G387 VanDerWaalsContact O-N 3.09Å; A383-S388 PolarHBondContact O-N 2.88Å; A383-S388 VanDerWaalsContact O-N 3.12Å; A383-I391 HydrophobicContact CB-CB 4.26Å; A383-I391 HydrophobicContact CB-CG2 3.57Å; A383-V392 HydrophobicContact CB-CG2 3.74Å; A383-L395 HydrophobicContact CB-CD1 3.98Å
384	A	98.3	Very high	96.7	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-65.7	-45.1	175.6	0	0	0	0	0	112.5	L380 H381 I382 R386 G387 V392 P411 V423 L427	L380-A384 WeakPolarHBondContact O-CB 3.32Å; L380-A384 PolarHBondContact O-N 3.34Å; H381-A384 PolarHBondContact O-N 3.39Å; I382-A384 VanDerWaalsContact C-N 3.27Å; I382-A384 PolarHBondContact O-N 3.19Å; A384-R386 VanDerWaalsContact C-N 3.28Å; A384-R386 PolarHBondContact O-N 2.93Å; A384-G387 PolarHBondContact O-N 3.32Å; A384-V392 HydrophobicContact CB-CG2 4.47Å; A384-P411 HydrophobicContact CB-CB 3.89Å; A384-V423 HydrophobicContact CB-CG1 3.7Å; A384-L427 HydrophobicContact CB-CD1 4.17Å
385	Q	97.1	Very high	97	Very high	50 Å²	50	26.4 Å²	26.4	23%	0.234	16%	0.156	C	C	.	.	H	α-helix	trans	-61.2	-35.5	175.3	-165.9	-179.9	51	0	0	112.5	H381 I382 L414 R418	H381-Q385 WeakPolarHBondContact O-CB 3.35Å; H381-Q385 PolarHBondContact O-N 3.49Å; I382-Q385 PolarHBondContact O-N 2.92Å; Q385-L414 HydrophobicContact CB-CB 4.01Å; Q385-L414 HydrophobicContact CB-CD1 4.46Å; Q385-L414 HydrophobicContact CG-CB 4.43Å; Q385-L414 HydrophobicContact CG-CD2 4.48Å; Q385-R418 HydrophobicContact CG-CG 3.92Å
386	R	96.1	Very high	97.4	Very high	122 Å²	122	24.8 Å²	24.8	46%	0.46	14%	0.144	S	C	.	.	H	α-helix	trans	-71.5	-31	177.1	-73.4	-60.7	-164.5	-153.2	3.2	112.7	K352 I382 A383 A384 R420	K352-R386 PolarHBondContact O-NE 3.05Å; K352-R386 PolarHBondContact O-NH2 2.84Å; I382-R386 HydrophobicContact CG2-CG 4.28Å; I382-R386 WeakPolarHBondContact O-CB 3.44Å; I382-R386 VanDerWaalsContact O-CG 3.32Å; I382-R386 WeakPolarHBondContact O-CG 3.46Å; I382-R386 PolarHBondContact O-N 2.94Å; A383-R386 PolarHBondContact O-N 2.9Å; A384-R386 VanDerWaalsContact C-N 3.28Å; A384-R386 PolarHBondContact O-N 2.93Å; R386-R420 PolarHBondContact O-NE 3.41Å; R386-R420 PolarHBondContact O-NH2 3.44Å
387	G	95.1	Very high	97.6	Very high	24 Å²	24	28.4 Å²	28.4	25%	0.247	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.4	47.9	-168.3	0	0	0	0	0	111.1	A383 A384	A383-G387 PolarHBondContact O-N 3.04Å; A383-G387 VanDerWaalsContact O-N 3.09Å; A384-G387 PolarHBondContact O-N 3.32Å
388	S	95.4	Very high	97.7	Very high	25 Å²	25	30.4 Å²	30.4	18%	0.175	18%	0.175	C	C	.	.			trans	-109.4	80.5	-176.9	-61.5	0	0	0	0	110.8	A383 A390 I391 V392	A383-S388 PolarHBondContact O-N 2.88Å; A383-S388 VanDerWaalsContact O-N 3.12Å; S388-A390 PolarHBondContact O-N 3.36Å; S388-I391 CarbonylContact O-C 3.5Å; S388-I391 WeakPolarHBondContact O-CA 3.37Å; S388-I391 WeakPolarHBondContact O-CB 3.49Å; S388-I391 PolarHBondContact O-N 2.84Å; S388-V392 PolarHBondContact O-N 3.28Å
389	D	96.7	Very high	97.7	Very high	68 Å²	68	30.9 Å²	30.9	36%	0.364	18%	0.178	S	C	.	.	H	α-helix	trans	-53.8	-50.6	-166	-52.1	-31.8	0	0	0	113.8	I391 V392 S393 V423 M426	D389-I391 PolarHBondContact O-N 2.99Å; D389-V392 WeakPolarHBondContact O-CB 3.47Å; D389-V392 PolarHBondContact O-N 3.34Å; D389-V392 VanDerWaalsContact O-N 3.13Å; D389-S393 PolarHBondContact O-N 3.5Å; D389-S393 PolarHBondContact O-OG 3.41Å; D389-V423 WeakPolarHBondContact OD1-CG2 3.37Å; D389-M426 HydrophobicContact CB-CE 3.69Å
390	A	97.9	Very high	97.6	Very high	32 Å²	32	33.3 Å²	33.3	26%	0.264	20%	0.195	S	C	.	.	H	α-helix	trans	-63.5	-27.6	178	0	0	0	0	0	113.3	Q356 S388 S393 M394	Q356-A390 HydrophobicContact CG-CB 4.04Å; S388-A390 PolarHBondContact O-N 3.36Å; A390-S393 PolarHBondContact O-OG 3.08Å; A390-M394 VanDerWaalsContact O-CE 3.24Å; A390-M394 WeakPolarHBondContact O-CE 2.99Å; A390-M394 VanDerWaalsContact O-CG 3.28Å; A390-M394 WeakPolarHBondContact O-CG 3.43Å; A390-M394 PolarHBondContact O-N 2.99Å
391	I	98.6	Very high	97.5	Very high	4 Å²	4	37.3 Å²	37.3	2%	0.021	21%	0.213	C	C	.	.	H	α-helix	trans	-79.8	-38.1	175.6	-65.1	178.5	0	0	0	110	A351 Q356 V359 A383 S388 D389 M394 L395	A351-I391 HydrophobicContact CB-CG2 3.9Å; Q356-I391 HydrophobicContact CB-CG1 4.31Å; Q356-I391 HydrophobicContact CG-CG1 4.5Å; V359-I391 HydrophobicContact CG1-CG2 4.25Å; V359-I391 HydrophobicContact CG2-CD1 4.2Å; V359-I391 HydrophobicContact CG2-CG1 4.39Å; V359-I391 HydrophobicContact CG2-CG2 4.23Å; A383-I391 HydrophobicContact CB-CB 4.26Å; A383-I391 HydrophobicContact CB-CG2 3.57Å; S388-I391 CarbonylContact O-C 3.5Å; S388-I391 WeakPolarHBondContact O-CA 3.37Å; S388-I391 WeakPolarHBondContact O-CB 3.49Å; S388-I391 PolarHBondContact O-N 2.84Å; D389-I391 PolarHBondContact O-N 2.99Å; I391-M394 HydrophobicContact CG1-CE 4.26Å; I391-M394 PolarHBondContact O-N 3.06Å; I391-L395 HydrophobicContact CG2-CD1 3.66Å; I391-L395 HydrophobicContact CG2-CG 4.35Å; I391-L395 VanDerWaalsContact O-CB 3.32Å; I391-L395 WeakPolarHBondContact O-CB 3.45Å; I391-L395 WeakPolarHBondContact O-CG 3.13Å; I391-L395 PolarHBondContact O-N 3.02Å
392	V	98.6	Very high	97.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-61.3	-50.4	174.1	169.4	0	0	0	0	110.5	L380 A383 A384 S388 D389 M394 L395 I396 V423 M426 L427	L380-V392 HydrophobicContact CD1-CB 4.48Å; L380-V392 HydrophobicContact CD1-CG1 4.11Å; A383-V392 HydrophobicContact CB-CG2 3.74Å; A384-V392 HydrophobicContact CB-CG2 4.47Å; S388-V392 PolarHBondContact O-N 3.28Å; D389-V392 WeakPolarHBondContact O-CB 3.47Å; D389-V392 PolarHBondContact O-N 3.34Å; D389-V392 VanDerWaalsContact O-N 3.13Å; V392-M394 VanDerWaalsContact C-N 3.33Å; V392-M394 PolarHBondContact O-N 2.8Å; V392-L395 PolarHBondContact O-N 2.61Å; V392-I396 HydrophobicContact CG1-CD1 3.68Å; V392-I396 HydrophobicContact CG1-CG1 4.21Å; V392-I396 WeakPolarHBondContact O-CG1 3.25Å; V392-I396 PolarHBondContact O-N 3.01Å; V392-V423 HydrophobicContact CG1-CG1 4.42Å; V392-V423 HydrophobicContact CG2-CG1 4.14Å; V392-V423 HydrophobicContact CG2-CG2 4.14Å; V392-M426 HydrophobicContact CB-CE 4.42Å; V392-M426 HydrophobicContact CG1-CE 4.27Å; V392-L427 HydrophobicContact CG1-CD2 4.38Å; V392-L427 HydrophobicContact CG1-CG 4.45Å
393	S	98.4	Very high	97.3	Very high	60 Å²	60	43.7 Å²	43.7	42%	0.42	24%	0.243	S	C	.	.	H	α-helix	trans	-62.2	-36.3	179.7	64.6	0	0	0	0	113.1	D389 A390 P397	D389-S393 PolarHBondContact O-N 3.5Å; D389-S393 PolarHBondContact O-OG 3.41Å; A390-S393 PolarHBondContact O-OG 3.08Å; S393-P397 WeakPolarHBondContact O-CD 3.26Å
394	M	98.6	Very high	97.2	Very high	39 Å²	39	44 Å²	44	19%	0.192	24%	0.244	C	C	.	.	H	α-helix	trans	-68.7	-33.2	171.6	-75	-170.1	-66.2	0	0	113.8	Q356 V359 Q360 L363 A390 I391 V392	Q356-M394 HydrophobicContact CG-CE 3.63Å; V359-M394 HydrophobicContact CB-CE 4.11Å; V359-M394 HydrophobicContact CG1-CE 3.79Å; Q360-M394 HydrophobicContact CB-CE 4.28Å; Q360-M394 HydrophobicContact CB-SD 3.54Å; Q360-M394 VanDerWaalsContact CB-SD 3.54Å; Q360-M394 HydrophobicContact CG-SD 3.75Å; L363-M394 HydrophobicContact CD1-CB 3.94Å; A390-M394 VanDerWaalsContact O-CE 3.24Å; A390-M394 WeakPolarHBondContact O-CE 2.99Å; A390-M394 VanDerWaalsContact O-CG 3.28Å; A390-M394 WeakPolarHBondContact O-CG 3.43Å; A390-M394 PolarHBondContact O-N 2.99Å; I391-M394 HydrophobicContact CG1-CE 4.26Å; I391-M394 PolarHBondContact O-N 3.06Å; V392-M394 VanDerWaalsContact C-N 3.33Å; V392-M394 PolarHBondContact O-N 2.8Å
395	L	98.4	Very high	97.1	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-86.5	-28.9	-175.7	-74.1	172.9	0	0	0	113.9	L347 A351 L363 A369 P379 L380 A383 I391 V392 V398 T399	L347-L395 HydrophobicContact CD1-CD2 4.38Å; L347-L395 HydrophobicContact CD2-CD2 4.33Å; A351-L395 HydrophobicContact CB-CD1 4.29Å; L363-L395 HydrophobicContact CD1-CD2 4.14Å; L363-L395 HydrophobicContact CD2-CD2 4.25Å; A369-L395 HydrophobicContact CB-CD2 4.01Å; P379-L395 HydrophobicContact CB-CD1 3.85Å; P379-L395 HydrophobicContact CB-CD2 4.18Å; L380-L395 HydrophobicContact CB-CB 4.26Å; L380-L395 HydrophobicContact CD1-CB 3.88Å; A383-L395 HydrophobicContact CB-CD1 3.98Å; I391-L395 HydrophobicContact CG2-CD1 3.66Å; I391-L395 HydrophobicContact CG2-CG 4.35Å; I391-L395 VanDerWaalsContact O-CB 3.32Å; I391-L395 WeakPolarHBondContact O-CB 3.45Å; I391-L395 WeakPolarHBondContact O-CG 3.13Å; I391-L395 PolarHBondContact O-N 3.02Å; V392-L395 PolarHBondContact O-N 2.61Å; L395-V398 HydrophobicContact CD2-CG2 4.29Å; L395-V398 VanDerWaalsContact O-CG2 3.23Å; L395-V398 WeakPolarHBondContact O-CG2 3.4Å; L395-V398 PolarHBondContact O-N 2.84Å; L395-T399 VanDerWaalsContact O-CB 3.27Å; L395-T399 WeakPolarHBondContact O-CB 3.46Å; L395-T399 PolarHBondContact O-N 3.42Å; L395-T399 PolarHBondContact O-OG1 3.38Å
396	I	98.4	Very high	96.9	Very high	37 Å²	37	58 Å²	58	19%	0.19	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-48.9	-55.1	177	-78.4	164.8	0	0	0	113	L380 V392 V398 T399 M426 L427 A430 F432	L380-I396 HydrophobicContact CD1-CG1 4.1Å; V392-I396 HydrophobicContact CG1-CD1 3.68Å; V392-I396 HydrophobicContact CG1-CG1 4.21Å; V392-I396 WeakPolarHBondContact O-CG1 3.25Å; V392-I396 PolarHBondContact O-N 3.01Å; I396-V398 VanDerWaalsContact C-N 3.28Å; I396-V398 PolarHBondContact O-N 2.82Å; I396-T399 PolarHBondContact O-N 3.43Å; I396-M426 HydrophobicContact CD1-CB 4.47Å; I396-L427 HydrophobicContact CD1-CD2 4.23Å; I396-L427 HydrophobicContact CG1-CD2 4.29Å; I396-A430 HydrophobicContact CD1-CB 4Å; I396-A430 HydrophobicContact CG1-CB 4.4Å; I396-A430 HydrophobicContact CG2-CB 3.63Å; I396-F432 HydrophobicContact CG1-CE2 4.31Å
397	P	97.7	Very high	96.9	Very high	105 Å²	105	53.1 Å²	53.1	68%	0.682	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-69.7	-21	-173.9	26.4	-35.5	0	0	0	114.3	S393	S393-P397 WeakPolarHBondContact O-CD 3.26Å
398	V	97.9	Very high	96.9	Very high	66 Å²	66	52.6 Å²	52.6	40%	0.4	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-99.6	-9.1	-179.1	-65.1	0	0	0	0	113.6	L363 A369 N370 L395 I396	L363-V398 HydrophobicContact CD1-CG2 4.45Å; L363-V398 HydrophobicContact CD2-CG2 3.9Å; A369-V398 HydrophobicContact CB-CB 4.27Å; A369-V398 HydrophobicContact CB-CG2 3.67Å; N370-V398 PolarHBondContact ND2-O 3.5Å; L395-V398 HydrophobicContact CD2-CG2 4.29Å; L395-V398 VanDerWaalsContact O-CG2 3.23Å; L395-V398 WeakPolarHBondContact O-CG2 3.4Å; L395-V398 PolarHBondContact O-N 2.84Å; I396-V398 VanDerWaalsContact C-N 3.28Å; I396-V398 PolarHBondContact O-N 2.82Å
399	T	97.8	Very high	97	Very high	9 Å²	9	51.9 Å²	51.9	6%	0.055	27%	0.268	C	S	.	.	S	Bend	trans	-94.4	121.1	-178.1	-57.8	0	0	0	0	111.2	L378 L380 L395 I396 K401 V404	L378-T399 HydrophobicContact CD1-CG2 3.83Å; L380-T399 HydrophobicContact CB-CG2 4.18Å; L380-T399 HydrophobicContact CD2-CG2 3.83Å; L395-T399 VanDerWaalsContact O-CB 3.27Å; L395-T399 WeakPolarHBondContact O-CB 3.46Å; L395-T399 PolarHBondContact O-N 3.42Å; L395-T399 PolarHBondContact O-OG1 3.38Å; I396-T399 PolarHBondContact O-N 3.43Å; T399-K401 PolarHBondContact O-N 2.95Å; T399-V404 HydrophobicContact CG2-CG2 3.66Å
400	S	97	Very high	97	Very high	51 Å²	51	49 Å²	49	36%	0.357	25%	0.253	S	S	.	.			trans	-68.3	114.9	176.2	-178.1	0	0	0	0	111.1	N370 A402 R403 V404	N370-S400 WeakPolarHBondContact OD1-CB 3.34Å; N370-S400 PolarHBondContact OD1-N 3.24Å; S400-A402 PolarHBondContact O-N 3.37Å; S400-A402 VanDerWaalsContact O-N 3.1Å; S400-A402 PolarHBondContact OG-N 3.47Å; S400-R403 WeakPolarHBondContact O-CA 3.41Å; S400-R403 WeakPolarHBondContact O-CB 3.49Å; S400-R403 PolarHBondContact O-N 2.75Å; S400-R403 PolarHBondContact OG-N 3.13Å; S400-V404 PolarHBondContact O-N 2.85Å
401	K	95.5	Very high	97	Very high	85 Å²	85	47.5 Å²	47.5	37%	0.37	24%	0.241	S	C	.	.	H	α-helix	trans	-52.6	-31.7	170.3	-65.3	-174.4	179	-177.9	0	112.5	T399 V404 R405 A430 G431 F432	T399-K401 PolarHBondContact O-N 2.95Å; K401-V404 PolarHBondContact O-N 3.47Å; K401-R405 PolarHBondContact O-N 3.45Å; K401-A430 WeakPolarHBondContact CE-O 3.28Å; K401-A430 PolarHBondContact NZ-O 3.36Å; K401-G431 PolarHBondContact NZ-O 2.96Å; K401-F432 HydrophobicContact CG-CZ 4.48Å
402	A	95.6	Very high	97	Very high	31 Å²	31	47.3 Å²	47.3	26%	0.256	24%	0.24	S	C	.	.	H	α-helix	trans	-72.5	-29.9	174.3	0	0	0	0	0	113.2	S400 R406	S400-A402 PolarHBondContact O-N 3.37Å; S400-A402 VanDerWaalsContact O-N 3.1Å; S400-A402 PolarHBondContact OG-N 3.47Å; A402-R406 WeakPolarHBondContact O-CG 3.49Å; A402-R406 PolarHBondContact O-NH1 2.85Å
403	R	96.3	Very high	97	Very high	110 Å²	110	47.4 Å²	47.4	42%	0.415	24%	0.24	S	C	.	.	H	α-helix	trans	-71.3	-41.3	170.2	-177	64	64.3	-171.8	1.8	110.4	N370 L378 S400 R406	N370-R403 HydrophobicContact CB-CB 4.48Å; N370-R403 HydrophobicContact CB-CG 4.16Å; L378-R403 HydrophobicContact CD1-CB 4.17Å; L378-R403 HydrophobicContact CD1-CG 3.67Å; L378-R403 HydrophobicContact CD2-CG 3.74Å; L378-R403 HydrophobicContact CG-CG 4.3Å; S400-R403 WeakPolarHBondContact O-CA 3.41Å; S400-R403 WeakPolarHBondContact O-CB 3.49Å; S400-R403 PolarHBondContact O-N 2.75Å; S400-R403 PolarHBondContact OG-N 3.13Å; R403-R406 PolarHBondContact O-N 3.27Å; R403-R406 VanDerWaalsContact O-N 3.12Å
404	V	96.8	Very high	97	Very high	5 Å²	5	44.9 Å²	44.9	3%	0.03	22%	0.222	C	C	.	.	H	α-helix	trans	-56.1	-50.7	174.9	171.4	0	0	0	0	111.5	L378 H381 T399 S400 K401 R406 T407 P411 F432	L378-V404 HydrophobicContact CD1-CG2 3.78Å; H381-V404 WeakPolarHBondContact CE1-CA 3.45Å; H381-V404 VanDerWaalsContact CE1-CG2 3.49Å; H381-V404 WeakPolarHBondContact CE1-CG2 3.38Å; H381-V404 WeakPolarHBondContact NE2-CG1 3.32Å; T399-V404 HydrophobicContact CG2-CG2 3.66Å; S400-V404 PolarHBondContact O-N 2.85Å; K401-V404 PolarHBondContact O-N 3.47Å; V404-R406 PolarHBondContact O-N 3.01Å; V404-R406 VanDerWaalsContact O-N 3.09Å; V404-T407 PolarHBondContact O-N 2.97Å; V404-T407 PolarHBondContact O-OG1 3.32Å; V404-P411 HydrophobicContact CG1-CG 4.33Å; V404-F432 HydrophobicContact CG1-CE1 4.17Å; V404-F432 HydrophobicContact CG2-CE1 4.19Å
405	R	94.5	Very high	97	Very high	176 Å²	176	43 Å²	43	66%	0.664	21%	0.213	S	C	*	.	H	α-helix	trans	-56.3	-30.1	177.6	-72.5	-170.2	-64	-98.1	7.3	113.8	K401 T407	K401-R405 PolarHBondContact O-N 3.45Å; R405-T407 VanDerWaalsContact C-N 3.33Å; R405-T407 PolarHBondContact O-N 3.33Å
406	R	94.1	Very high	97	Very high	169 Å²	169	43 Å²	43	64%	0.638	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-9.4	178.9	-67.1	179.7	-170.1	101.7	-13.5	114.5	A402 R403 V404 G408	A402-R406 WeakPolarHBondContact O-CG 3.49Å; A402-R406 PolarHBondContact O-NH1 2.85Å; R403-R406 PolarHBondContact O-N 3.27Å; R403-R406 VanDerWaalsContact O-N 3.12Å; V404-R406 PolarHBondContact O-N 3.01Å; V404-R406 VanDerWaalsContact O-N 3.09Å; R406-G408 VanDerWaalsContact C-N 3.29Å
407	T	95.2	Very high	96.9	Very high	19 Å²	19	43 Å²	43	12%	0.117	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-11.3	176.4	71.2	0	0	0	0	113.2	G376 L378 H381 V404 R405 I409 R442	G376-T407 WeakPolarHBondContact O-CG2 3.32Å; L378-T407 HydrophobicContact CG-CG2 4.19Å; H381-T407 WeakPolarHBondContact CE1-CG2 3.43Å; H381-T407 PolarHBondContact NE2-OG1 2.91Å; V404-T407 PolarHBondContact O-N 2.97Å; V404-T407 PolarHBondContact O-OG1 3.32Å; R405-T407 VanDerWaalsContact C-N 3.33Å; R405-T407 PolarHBondContact O-N 3.33Å; T407-I409 PolarHBondContact O-N 3.32Å; T407-I409 PolarHBondContact OG1-N 3.06Å; T407-I409 PolarHBondContact OG1-O 3.43Å; T407-R442 PolarHBondContact O-NE 3.01Å; T407-R442 PolarHBondContact O-NH2 3.03Å
408	G	95.3	Very high	96.9	Very high	14 Å²	14	44.1 Å²	44.1	14%	0.144	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	72	9.8	-172.8	0	0	0	0	0	114.5	R406 L438 S439 R442	R406-G408 VanDerWaalsContact C-N 3.29Å; G408-L438 CarbonylContact O-C 3.6Å; G408-L438 WeakPolarHBondContact O-CA 3.49Å; G408-S439 PolarHBondContact O-N 3.22Å; G408-R442 WeakPolarHBondContact O-CD 3.46Å
409	I	97.1	Very high	96.9	Very high	9 Å²	9	44.4 Å²	44.4	5%	0.046	20%	0.202	C	C	.	.			trans	-147.7	123.6	178.7	-177.3	162.2	0	0	0	110.7	H381 T407 H413 L414 L438	H381-I409 PolarHBondContact CD2-O 2.88Å; H381-I409 PolarHBondContact NE2-O 3.15Å; T407-I409 PolarHBondContact O-N 3.32Å; T407-I409 PolarHBondContact OG1-N 3.06Å; T407-I409 PolarHBondContact OG1-O 3.43Å; I409-H413 HydrophobicContact CD1-CB 4.19Å; I409-H413 HydrophobicContact CG1-CB 3.99Å; I409-L414 HydrophobicContact CD1-CD1 4.41Å; I409-L414 HydrophobicContact CD1-CD2 3.75Å; I409-L414 HydrophobicContact CD1-CG 3.93Å; I409-L414 HydrophobicContact CG1-CG 4.42Å; I409-L438 HydrophobicContact CB-CD2 3.83Å; I409-L438 HydrophobicContact CD1-CD2 3.83Å; I409-L438 HydrophobicContact CG1-CD2 3.6Å
410	S	97.7	Very high	96.9	Very high	8 Å²	8	48.8 Å²	48.8	6%	0.056	22%	0.217	C	C	.	.			trans	-74.9	143	169.7	-178.1	0	0	0	0	110.8	L412 H413	S410-L412 PolarHBondContact O-N 2.9Å; S410-L412 VanDerWaalsContact O-N 3.12Å; S410-L412 PolarHBondContact OG-N 3Å; S410-H413 WeakPolarHBondContact CB-ND1 3.15Å; S410-H413 PolarHBondContact N-ND1 2.74Å; S410-H413 VanDerWaalsContact N-ND1 3.13Å; S410-H413 WeakPolarHBondContact O-CB 3.33Å; S410-H413 PolarHBondContact O-N 2.79Å; S410-H413 PolarHBondContact O-ND1 3.25Å
411	P	98.1	Very high	97	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-52.4	-27.5	170.4	-26.8	35	0	0	0	113.8	L380 A384 V404 H413 L414 A415 L427 F432	L380-P411 HydrophobicContact CD2-CG 4.08Å; L380-P411 HydrophobicContact CG-CB 4.49Å; L380-P411 HydrophobicContact CG-CG 4.05Å; A384-P411 HydrophobicContact CB-CB 3.89Å; V404-P411 HydrophobicContact CG1-CG 4.33Å; P411-H413 VanDerWaalsContact C-N 3.28Å; P411-H413 PolarHBondContact O-N 3.15Å; P411-L414 PolarHBondContact O-N 3.28Å; P411-A415 PolarHBondContact O-N 3.42Å; P411-L427 HydrophobicContact CB-CD1 3.73Å; P411-L427 HydrophobicContact CB-CD2 4.09Å; P411-F432 HydrophobicContact CG-CE1 4.18Å
412	L	98.3	Very high	97.1	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-55.5	-38.5	173.5	-69.8	172.5	0	0	0	112.9	S410 L414 A415 A416 L424 L427 I428 F432 D433 V434 A453	S410-L412 PolarHBondContact O-N 2.9Å; S410-L412 VanDerWaalsContact O-N 3.12Å; S410-L412 PolarHBondContact OG-N 3Å; L412-L414 VanDerWaalsContact C-N 3.3Å; L412-L414 PolarHBondContact O-N 3Å; L412-A415 PolarHBondContact O-N 3.24Å; L412-A416 VanDerWaalsContact O-CB 3.32Å; L412-A416 WeakPolarHBondContact O-CB 3.35Å; L412-A416 PolarHBondContact O-N 2.94Å; L412-L424 HydrophobicContact CB-CD1 4.24Å; L412-L424 HydrophobicContact CD2-CD1 3.63Å; L412-L424 HydrophobicContact CD2-CG 4.27Å; L412-L424 WeakPolarHBondContact O-CD1 3.12Å; L412-L427 HydrophobicContact CD2-CB 3.42Å; L412-L427 VanDerWaalsContact CD2-CB 3.42Å; L412-L427 HydrophobicContact CD2-CD1 4.11Å; L412-L427 HydrophobicContact CD2-CG 4.44Å; L412-L427 HydrophobicContact CG-CB 4.17Å; L412-L427 HydrophobicContact CG-CD1 4.5Å; L412-I428 HydrophobicContact CD2-CG1 3.99Å; L412-F432 HydrophobicContact CD1-CB 3.83Å; L412-F432 HydrophobicContact CG-CB 4.16Å; L412-D433 WeakPolarHBondContact CD1-O 3.47Å; L412-V434 HydrophobicContact CD1-CG1 4.07Å; L412-A453 HydrophobicContact CB-CB 3.99Å
413	H	98.5	Very high	97.2	Very high	2 Å²	2	48 Å²	48	1%	0.009	21%	0.209	C	C	.	.	H	α-helix	trans	-62.6	-39.3	176	-59.2	91.5	0	0	0	111.8	I409 S410 P411 E417 A436 L438 S451 A453 F456	I409-H413 HydrophobicContact CD1-CB 4.19Å; I409-H413 HydrophobicContact CG1-CB 3.99Å; S410-H413 WeakPolarHBondContact CB-ND1 3.15Å; S410-H413 PolarHBondContact N-ND1 2.74Å; S410-H413 VanDerWaalsContact N-ND1 3.13Å; S410-H413 WeakPolarHBondContact O-CB 3.33Å; S410-H413 PolarHBondContact O-N 2.79Å; S410-H413 PolarHBondContact O-ND1 3.25Å; P411-H413 VanDerWaalsContact C-N 3.28Å; P411-H413 PolarHBondContact O-N 3.15Å; H413-E417 WeakPolarHBondContact O-CB 3.3Å; H413-E417 PolarHBondContact O-N 3.04Å; H413-A436 PolarHBondContact CE1-O 3.23Å; H413-A436 PolarHBondContact NE2-O 3.43Å; H413-A436 VanDerWaalsContact NE2-O 3.08Å; H413-L438 HydrophobicContact CB-CD2 4.46Å; H413-S451 PolarHBondContact NE2-O 2.88Å; H413-A453 PolarHBondContact CD2-N 3.31Å; H413-A453 PolarHBondContact NE2-N 3Å; H413-F456 HydrophobicContact CB-CD2 4.33Å; H413-F456 HydrophobicContact CB-CE2 4.24Å; H413-F456 AromaticContact CD2-CD2 3.92Å; H413-F456 AromaticContact CD2-CE2 3.77Å
414	L	98.1	Very high	97.3	Very high	6 Å²	6	42.8 Å²	42.8	3%	0.031	19%	0.189	C	C	.	.	H	α-helix	trans	-77.2	-32.1	-176.5	-62.9	172.7	0	0	0	111.6	M377 H381 Q385 I409 P411 L412 R418	M377-L414 HydrophobicContact SD-CD1 3.91Å; H381-L414 HydrophobicContact CB-CD1 3.66Å; H381-L414 WeakPolarHBondContact O-CD1 3.33Å; Q385-L414 HydrophobicContact CB-CB 4.01Å; Q385-L414 HydrophobicContact CB-CD1 4.46Å; Q385-L414 HydrophobicContact CG-CB 4.43Å; Q385-L414 HydrophobicContact CG-CD2 4.48Å; I409-L414 HydrophobicContact CD1-CD1 4.41Å; I409-L414 HydrophobicContact CD1-CD2 3.75Å; I409-L414 HydrophobicContact CD1-CG 3.93Å; I409-L414 HydrophobicContact CG1-CG 4.42Å; P411-L414 PolarHBondContact O-N 3.28Å; L412-L414 VanDerWaalsContact C-N 3.3Å; L412-L414 PolarHBondContact O-N 3Å; L414-R418 WeakPolarHBondContact O-CB 3.47Å; L414-R418 VanDerWaalsContact O-CG 3.32Å; L414-R418 WeakPolarHBondContact O-CG 3.47Å; L414-R418 PolarHBondContact O-N 2.61Å
415	A	98.4	Very high	97.4	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-66.1	-49	169.7	0	0	0	0	0	110.9	P411 L412 R418 N419 R420 V423 L424 L427	P411-A415 PolarHBondContact O-N 3.42Å; L412-A415 PolarHBondContact O-N 3.24Å; A415-R418 CarbonylContact O-C 3.43Å; A415-R418 PolarHBondContact O-N 3.07Å; A415-N419 PolarHBondContact O-N 3.08Å; A415-R420 HydrophobicContact CB-CB 4.25Å; A415-R420 PolarHBondContact O-N 2.94Å; A415-V423 HydrophobicContact CB-CB 4.33Å; A415-V423 HydrophobicContact CB-CG1 3.73Å; A415-L424 HydrophobicContact CB-CB 4.19Å; A415-L424 HydrophobicContact CB-CD1 3.81Å; A415-L427 HydrophobicContact CB-CD1 4.36Å
416	A	98.3	Very high	97.6	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-64.4	-44	177.3	0	0	0	0	0	112.9	L412 R418 N419 L424 A453 F456 A457 N460	L412-A416 VanDerWaalsContact O-CB 3.32Å; L412-A416 WeakPolarHBondContact O-CB 3.35Å; L412-A416 PolarHBondContact O-N 2.94Å; A416-R418 PolarHBondContact O-N 3.22Å; A416-R418 VanDerWaalsContact O-N 3.15Å; A416-N419 PolarHBondContact O-N 3.4Å; A416-N419 PolarHBondContact O-OD1 3.4Å; A416-L424 HydrophobicContact CB-CD1 4.27Å; A416-A453 HydrophobicContact CB-CB 4.5Å; A416-A453 WeakPolarHBondContact CB-O 3.31Å; A416-F456 HydrophobicContact CB-CB 3.79Å; A416-A457 HydrophobicContact CB-CB 4.49Å; A416-N460 PolarHBondContact O-ND2 3.21Å
417	E	97.1	Very high	97.8	Very high	38 Å²	38	32.7 Å²	32.7	18%	0.178	16%	0.157	C	C	.	.	H	α-helix	trans	-57.1	-29.6	175.8	-174.9	-170.4	-107.5	0	0	112	H413 Y446 F456 N460	H413-E417 WeakPolarHBondContact O-CB 3.3Å; H413-E417 PolarHBondContact O-N 3.04Å; E417-Y446 PolarHBondContact OE1-OH 2.91Å; E417-F456 HydrophobicContact CB-CD1 3.67Å; E417-F456 HydrophobicContact CB-CE1 4.07Å; E417-F456 HydrophobicContact CB-CG 4.42Å; E417-F456 HydrophobicContact CG-CD1 3.95Å; E417-F456 HydrophobicContact CG-CE1 4.04Å; E417-N460 VanDerWaalsContact C-ND2 3.35Å; E417-N460 PolarHBondContact O-ND2 3.34Å
418	R	97.8	Very high	98	Very high	127 Å²	127	33.4 Å²	33.4	48%	0.479	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.1	10.3	-174.8	-58.5	-60.5	171.9	160.1	-5	114.3	Q385 L414 A415 A416 R420	Q385-R418 HydrophobicContact CG-CG 3.92Å; L414-R418 WeakPolarHBondContact O-CB 3.47Å; L414-R418 VanDerWaalsContact O-CG 3.32Å; L414-R418 WeakPolarHBondContact O-CG 3.47Å; L414-R418 PolarHBondContact O-N 2.61Å; A415-R418 CarbonylContact O-C 3.43Å; A415-R418 PolarHBondContact O-N 3.07Å; A416-R418 PolarHBondContact O-N 3.22Å; A416-R418 VanDerWaalsContact O-N 3.15Å; R418-R420 VanDerWaalsContact C-N 3.34Å; R418-R420 HydrophobicContact CB-CG 3.91Å; R418-R420 WeakPolarHBondContact O-CD 3.27Å; R418-R420 PolarHBondContact O-N 2.72Å
419	N	97.8	Very high	98.1	Very high	72 Å²	72	39.9 Å²	39.9	39%	0.385	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.7	54.9	-177.6	-59.1	-20	0	0	0	111.6	A415 A416 N460 N462	A415-N419 PolarHBondContact O-N 3.08Å; A416-N419 PolarHBondContact O-N 3.4Å; A416-N419 PolarHBondContact O-OD1 3.4Å; N419-N460 WeakPolarHBondContact OD1-CB 3.36Å; N419-N460 PolarHBondContact OD1-ND2 3.27Å; N419-N460 VanDerWaalsContact OD1-ND2 3.07Å; N419-N462 PolarHBondContact OD1-ND2 3.4Å
420	R	98	Very high	98.1	Very high	102 Å²	102	40.8 Å²	40.8	39%	0.385	20%	0.195	S	C	.	.			trans	-103.2	77.6	177	-54.7	-49.7	-161.3	-172.8	13.7	108.8	R386 A415 R418 V423 L424	R386-R420 PolarHBondContact O-NE 3.41Å; R386-R420 PolarHBondContact O-NH2 3.44Å; A415-R420 HydrophobicContact CB-CB 4.25Å; A415-R420 PolarHBondContact O-N 2.94Å; R418-R420 VanDerWaalsContact C-N 3.34Å; R418-R420 HydrophobicContact CB-CG 3.91Å; R418-R420 WeakPolarHBondContact O-CD 3.27Å; R418-R420 PolarHBondContact O-N 2.72Å; R420-V423 HydrophobicContact CB-CB 3.86Å; R420-V423 HydrophobicContact CB-CG2 4.14Å; R420-V423 WeakPolarHBondContact O-CB 3.36Å; R420-V423 PolarHBondContact O-N 3.21Å; R420-L424 WeakPolarHBondContact O-CB 3.25Å; R420-L424 PolarHBondContact O-N 3.48Å
421	D	97.9	Very high	98.1	Very high	48 Å²	48	42.6 Å²	42.6	26%	0.257	22%	0.215	S	C	.	.	H	α-helix	trans	-68.9	-43	-166.4	-61.7	-15.6	0	0	0	111.4	V423 L424 E425 N462 M468	D421-V423 VanDerWaalsContact C-N 3.34Å; D421-V423 PolarHBondContact O-N 3.38Å; D421-L424 WeakPolarHBondContact O-CA 3.26Å; D421-L424 WeakPolarHBondContact O-CB 3.43Å; D421-L424 PolarHBondContact O-N 3.08Å; D421-E425 PolarHBondContact O-N 3.47Å; D421-N462 PolarHBondContact OD1-ND2 3.21Å; D421-N462 PolarHBondContact OD2-ND2 3.26Å; D421-M468 HydrophobicContact CB-CE 3.82Å
422	D	98.2	Very high	98.1	Very high	103 Å²	103	43.2 Å²	43.2	55%	0.551	22%	0.218	S	C	*	.	H	α-helix	trans	-60.6	-41.7	175	-43.3	-86	0	0	0	112	L424 E425 M426	D422-L424 VanDerWaalsContact C-N 3.35Å; D422-E425 PolarHBondContact O-N 2.85Å; D422-M426 WeakPolarHBondContact O-CE 3.41Å; D422-M426 PolarHBondContact O-N 2.86Å
423	V	98.5	Very high	98.1	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-63.1	-40.9	172.7	168.3	0	0	0	0	111.8	A384 D389 V392 A415 R420 D421 M426 L427	A384-V423 HydrophobicContact CB-CG1 3.7Å; D389-V423 WeakPolarHBondContact OD1-CG2 3.37Å; V392-V423 HydrophobicContact CG1-CG1 4.42Å; V392-V423 HydrophobicContact CG2-CG1 4.14Å; V392-V423 HydrophobicContact CG2-CG2 4.14Å; A415-V423 HydrophobicContact CB-CB 4.33Å; A415-V423 HydrophobicContact CB-CG1 3.73Å; R420-V423 HydrophobicContact CB-CB 3.86Å; R420-V423 HydrophobicContact CB-CG2 4.14Å; R420-V423 WeakPolarHBondContact O-CB 3.36Å; R420-V423 PolarHBondContact O-N 3.21Å; D421-V423 VanDerWaalsContact C-N 3.34Å; D421-V423 PolarHBondContact O-N 3.38Å; V423-M426 HydrophobicContact CG2-CE 4.29Å; V423-L427 HydrophobicContact CG1-CD1 3.76Å; V423-L427 HydrophobicContact CG1-CG 4.37Å; V423-L427 WeakPolarHBondContact O-CB 3.42Å; V423-L427 WeakPolarHBondContact O-CD1 3.3Å; V423-L427 WeakPolarHBondContact O-CG 3.47Å; V423-L427 PolarHBondContact O-N 2.96Å
424	L	98.4	Very high	98	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-64.6	-45.3	-179.4	-165.3	76.2	0	0	0	110	L412 A415 A416 R420 D421 D422 L427 I428 A465 M468 L469	L412-L424 HydrophobicContact CB-CD1 4.24Å; L412-L424 HydrophobicContact CD2-CD1 3.63Å; L412-L424 HydrophobicContact CD2-CG 4.27Å; L412-L424 WeakPolarHBondContact O-CD1 3.12Å; A415-L424 HydrophobicContact CB-CB 4.19Å; A415-L424 HydrophobicContact CB-CD1 3.81Å; A416-L424 HydrophobicContact CB-CD1 4.27Å; R420-L424 WeakPolarHBondContact O-CB 3.25Å; R420-L424 PolarHBondContact O-N 3.48Å; D421-L424 WeakPolarHBondContact O-CA 3.26Å; D421-L424 WeakPolarHBondContact O-CB 3.43Å; D421-L424 PolarHBondContact O-N 3.08Å; D422-L424 VanDerWaalsContact C-N 3.35Å; L424-L427 PolarHBondContact O-N 2.79Å; L424-I428 HydrophobicContact CG-CD1 4.13Å; L424-I428 VanDerWaalsContact O-CG1 3.26Å; L424-I428 WeakPolarHBondContact O-CG1 3.42Å; L424-I428 PolarHBondContact O-N 2.98Å; L424-A465 HydrophobicContact CD2-CB 3.51Å; L424-M468 HydrophobicContact CD2-CE 4.24Å; L424-L469 HydrophobicContact CD1-CD2 4.46Å; L424-L469 HydrophobicContact CD2-CD1 4.12Å; L424-L469 HydrophobicContact CD2-CG 4.04Å
425	E	98.6	Very high	98	Very high	97 Å²	97	50.1 Å²	50.1	45%	0.453	26%	0.255	S	S	.	.	H	α-helix	trans	-56.3	-56.5	174	-170.7	172.3	-136.9	0	0	111.1	D421 D422 L427 I428 E429 M468	D421-E425 PolarHBondContact O-N 3.47Å; D422-E425 PolarHBondContact O-N 2.85Å; E425-L427 PolarHBondContact O-N 2.88Å; E425-L427 VanDerWaalsContact O-N 3.15Å; E425-I428 CarbonylContact O-C 3.55Å; E425-I428 WeakPolarHBondContact O-CA 3.45Å; E425-I428 WeakPolarHBondContact O-CB 3.28Å; E425-I428 PolarHBondContact O-N 2.8Å; E425-E429 HydrophobicContact CG-CG 4.45Å; E425-E429 WeakPolarHBondContact O-CG 3.47Å; E425-E429 PolarHBondContact O-N 2.85Å; E425-M468 HydrophobicContact CB-SD 3.84Å; E425-M468 HydrophobicContact CG-SD 4.24Å
426	M	98.4	Very high	98	Very high	41 Å²	41	51.2 Å²	51.2	20%	0.202	26%	0.264	C	S	.	.	H	α-helix	trans	-57.1	-34.3	178.6	-76	-175.4	-66.9	0	0	113.8	D389 V392 I396 D422 V423 A430	D389-M426 HydrophobicContact CB-CE 3.69Å; V392-M426 HydrophobicContact CB-CE 4.42Å; V392-M426 HydrophobicContact CG1-CE 4.27Å; I396-M426 HydrophobicContact CD1-CB 4.47Å; D422-M426 WeakPolarHBondContact O-CE 3.41Å; D422-M426 PolarHBondContact O-N 2.86Å; V423-M426 HydrophobicContact CG2-CE 4.29Å; M426-A430 WeakPolarHBondContact O-CB 3.22Å; M426-A430 PolarHBondContact O-N 2.78Å
427	L	98.5	Very high	98	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-73.7	-36.1	176.4	-72.8	169.3	0	0	0	111.9	L380 A384 V392 I396 P411 L412 A415 V423 L424 E425 G431 F432	L380-L427 HydrophobicContact CD1-CD2 4.46Å; A384-L427 HydrophobicContact CB-CD1 4.17Å; V392-L427 HydrophobicContact CG1-CD2 4.38Å; V392-L427 HydrophobicContact CG1-CG 4.45Å; I396-L427 HydrophobicContact CD1-CD2 4.23Å; I396-L427 HydrophobicContact CG1-CD2 4.29Å; P411-L427 HydrophobicContact CB-CD1 3.73Å; P411-L427 HydrophobicContact CB-CD2 4.09Å; L412-L427 HydrophobicContact CD2-CB 3.42Å; L412-L427 VanDerWaalsContact CD2-CB 3.42Å; L412-L427 HydrophobicContact CD2-CD1 4.11Å; L412-L427 HydrophobicContact CD2-CG 4.44Å; L412-L427 HydrophobicContact CG-CB 4.17Å; L412-L427 HydrophobicContact CG-CD1 4.5Å; A415-L427 HydrophobicContact CB-CD1 4.36Å; V423-L427 HydrophobicContact CG1-CD1 3.76Å; V423-L427 HydrophobicContact CG1-CG 4.37Å; V423-L427 WeakPolarHBondContact O-CB 3.42Å; V423-L427 WeakPolarHBondContact O-CD1 3.3Å; V423-L427 WeakPolarHBondContact O-CG 3.47Å; V423-L427 PolarHBondContact O-N 2.96Å; L424-L427 PolarHBondContact O-N 2.79Å; E425-L427 PolarHBondContact O-N 2.88Å; E425-L427 VanDerWaalsContact O-N 3.15Å; L427-G431 PolarHBondContact O-N 2.84Å; L427-F432 HydrophobicContact CB-CD2 4.4Å; L427-F432 HydrophobicContact CD2-CD2 3.88Å; L427-F432 HydrophobicContact CD2-CE2 3.84Å; L427-F432 HydrophobicContact CD2-CG 4.26Å; L427-F432 HydrophobicContact CD2-CZ 4.18Å; L427-F432 WeakPolarHBondContact O-CB 3.38Å; L427-F432 VanDerWaalsContact O-CD2 3.31Å; L427-F432 WeakPolarHBondContact O-CD2 3.49Å; L427-F432 PolarHBondContact O-N 2.92Å
428	I	98.4	Very high	98	Very high	34 Å²	34	54.8 Å²	54.8	17%	0.174	28%	0.281	C	S	.	.	H	α-helix	trans	-64.4	-51	172.7	-72.7	166.2	0	0	0	109.9	L412 L424 E425 A430 G431 V434 M468 L469 A472	L412-I428 HydrophobicContact CD2-CG1 3.99Å; L424-I428 HydrophobicContact CG-CD1 4.13Å; L424-I428 VanDerWaalsContact O-CG1 3.26Å; L424-I428 WeakPolarHBondContact O-CG1 3.42Å; L424-I428 PolarHBondContact O-N 2.98Å; E425-I428 CarbonylContact O-C 3.55Å; E425-I428 WeakPolarHBondContact O-CA 3.45Å; E425-I428 WeakPolarHBondContact O-CB 3.28Å; E425-I428 PolarHBondContact O-N 2.8Å; I428-A430 VanDerWaalsContact C-N 3.29Å; I428-A430 PolarHBondContact O-N 2.8Å; I428-G431 WeakPolarHBondContact O-CA 3.42Å; I428-G431 PolarHBondContact O-N 2.86Å; I428-V434 HydrophobicContact CG1-CG1 3.98Å; I428-M468 HydrophobicContact CD1-CB 3.95Å; I428-L469 HydrophobicContact CD1-CD2 4.02Å; I428-L469 HydrophobicContact CD1-CG 4.36Å; I428-L469 HydrophobicContact CG1-CD2 4.47Å; I428-A472 HydrophobicContact CD1-CB 4.46Å; I428-A472 HydrophobicContact CG1-CB 4.49Å; I428-A472 HydrophobicContact CG2-CB 3.52Å
429	E	98.3	Very high	97.8	Very high	149 Å²	149	50.6 Å²	50.6	70%	0.696	27%	0.271	S	S	*	.	H	α-helix	trans	-58.9	-39.2	176.9	-68.8	-170.8	138.6	0	0	112.4	E425 G431	E425-E429 HydrophobicContact CG-CG 4.45Å; E425-E429 WeakPolarHBondContact O-CG 3.47Å; E425-E429 PolarHBondContact O-N 2.85Å; E429-G431 PolarHBondContact O-N 2.85Å; E429-G431 VanDerWaalsContact O-N 3.07Å
430	A	97.8	Very high	97.6	Very high	29 Å²	29	53.2 Å²	53.2	24%	0.24	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-0.5	173.3	0	0	0	0	0	113.7	I396 K401 M426 I428 F432	I396-A430 HydrophobicContact CD1-CB 4Å; I396-A430 HydrophobicContact CG1-CB 4.4Å; I396-A430 HydrophobicContact CG2-CB 3.63Å; K401-A430 WeakPolarHBondContact CE-O 3.28Å; K401-A430 PolarHBondContact NZ-O 3.36Å; M426-A430 WeakPolarHBondContact O-CB 3.22Å; M426-A430 PolarHBondContact O-N 2.78Å; I428-A430 VanDerWaalsContact C-N 3.29Å; I428-A430 PolarHBondContact O-N 2.8Å; A430-F432 HydrophobicContact CB-CD2 3.99Å; A430-F432 HydrophobicContact CB-CE2 4.06Å
431	G	96.8	Very high	97.4	Very high	45 Å²	45	55 Å²	55	46%	0.464	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.6	42.9	178	0	0	0	0	0	112.8	K401 L427 I428 E429	K401-G431 PolarHBondContact NZ-O 2.96Å; L427-G431 PolarHBondContact O-N 2.84Å; I428-G431 WeakPolarHBondContact O-CA 3.42Å; I428-G431 PolarHBondContact O-N 2.86Å; E429-G431 PolarHBondContact O-N 2.85Å; E429-G431 VanDerWaalsContact O-N 3.07Å
432	F	97.9	Very high	97.2	Very high	14 Å²	14	55.2 Å²	55.2	6%	0.061	29%	0.291	C	S	.	.			trans	-73.9	143.8	162.2	-77.6	-105.9	0	0	0	109.5	L380 I396 K401 V404 P411 L412 L427 A430 V434	L380-F432 HydrophobicContact CD2-CE1 4.05Å; L380-F432 HydrophobicContact CD2-CE2 4.46Å; L380-F432 HydrophobicContact CD2-CZ 3.55Å; I396-F432 HydrophobicContact CG1-CE2 4.31Å; K401-F432 HydrophobicContact CG-CZ 4.48Å; V404-F432 HydrophobicContact CG1-CE1 4.17Å; V404-F432 HydrophobicContact CG2-CE1 4.19Å; P411-F432 HydrophobicContact CG-CE1 4.18Å; L412-F432 HydrophobicContact CD1-CB 3.83Å; L412-F432 HydrophobicContact CG-CB 4.16Å; L427-F432 HydrophobicContact CB-CD2 4.4Å; L427-F432 HydrophobicContact CD2-CD2 3.88Å; L427-F432 HydrophobicContact CD2-CE2 3.84Å; L427-F432 HydrophobicContact CD2-CG 4.26Å; L427-F432 HydrophobicContact CD2-CZ 4.18Å; L427-F432 WeakPolarHBondContact O-CB 3.38Å; L427-F432 VanDerWaalsContact O-CD2 3.31Å; L427-F432 WeakPolarHBondContact O-CD2 3.49Å; L427-F432 PolarHBondContact O-N 2.92Å; A430-F432 HydrophobicContact CB-CD2 3.99Å; A430-F432 HydrophobicContact CB-CE2 4.06Å; F432-V434 PolarHBondContact O-N 2.77Å
433	D	97.7	Very high	97	Very high	92 Å²	92	51 Å²	51	49%	0.492	27%	0.269	S	S	.	.			trans	-70.1	112	-178.6	177	8.9	0	0	0	110.3	L412 N435 A436	L412-D433 WeakPolarHBondContact CD1-O 3.47Å; D433-N435 VanDerWaalsContact C-N 3.25Å; D433-N435 PolarHBondContact O-N 3.1Å; D433-N435 WeakPolarHBondContact OD1-CA 3.38Å; D433-N435 PolarHBondContact OD1-N 3.34Å; D433-A436 HydrophobicContact CB-CB 4.05Å; D433-A436 VanDerWaalsContact O-CB 3.29Å; D433-A436 WeakPolarHBondContact O-CB 3.25Å; D433-A436 PolarHBondContact O-N 2.97Å; D433-A436 PolarHBondContact OD1-N 2.98Å
434	V	97.9	Very high	96.8	Very high	11 Å²	11	57.2 Å²	57.2	7%	0.067	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-21.3	179.1	-63	0	0	0	0	113.1	L412 I428 F432 L469 A472 A474	L412-V434 HydrophobicContact CD1-CG1 4.07Å; I428-V434 HydrophobicContact CG1-CG1 3.98Å; F432-V434 PolarHBondContact O-N 2.77Å; V434-L469 HydrophobicContact CB-CD2 4.09Å; V434-L469 HydrophobicContact CG1-CD2 3.93Å; V434-A472 HydrophobicContact CG1-CB 3.98Å; V434-A474 HydrophobicContact CB-CB 4.3Å; V434-A474 HydrophobicContact CG2-CB 4.13Å
435	N	98.1	Very high	96.5	Very high	50 Å²	50	63.6 Å²	63.6	27%	0.267	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	3.5	177.9	-69.5	-45.6	0	0	0	112.8	D433 Q437 G473 A474 D475 L478	D433-N435 VanDerWaalsContact C-N 3.25Å; D433-N435 PolarHBondContact O-N 3.1Å; D433-N435 WeakPolarHBondContact OD1-CA 3.38Å; D433-N435 PolarHBondContact OD1-N 3.34Å; N435-Q437 PolarHBondContact O-N 3.41Å; N435-Q437 VanDerWaalsContact O-N 3.1Å; N435-G473 PolarHBondContact ND2-O 3.19Å; N435-A474 VanDerWaalsContact OD1-CA 3.3Å; N435-A474 WeakPolarHBondContact OD1-CA 3.46Å; N435-D475 PolarHBondContact OD1-N 3.07Å; N435-L478 HydrophobicContact CB-CD1 3.77Å; N435-L478 WeakPolarHBondContact OD1-CD1 3.33Å
436	A	97.6	Very high	96.1	Very high	23 Å²	23	61.3 Å²	61.3	19%	0.19	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-60.5	116.1	174.9	0	0	0	0	0	110.1	H413 D433	H413-A436 PolarHBondContact CE1-O 3.23Å; H413-A436 PolarHBondContact NE2-O 3.43Å; H413-A436 VanDerWaalsContact NE2-O 3.08Å; D433-A436 HydrophobicContact CB-CB 4.05Å; D433-A436 VanDerWaalsContact O-CB 3.29Å; D433-A436 WeakPolarHBondContact O-CB 3.25Å; D433-A436 PolarHBondContact O-N 2.97Å; D433-A436 PolarHBondContact OD1-N 2.98Å
437	Q	97.4	Very high	95.7	Very high	102 Å²	102	69 Å²	69	48%	0.477	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-83.6	153.1	176.8	-64.6	-178.3	-76.9	0	0	112	N435 S451 T452 L478	N435-Q437 PolarHBondContact O-N 3.41Å; N435-Q437 VanDerWaalsContact O-N 3.1Å; Q437-S451 CarbonylContact C-O 3.59Å; Q437-S451 WeakPolarHBondContact CA-O 3.34Å; Q437-S451 PolarHBondContact NE2-OG 3.25Å; Q437-T452 HydrophobicContact CG-CG2 4.23Å; Q437-L478 PolarHBondContact NE2-O 3.05Å
438	L	97.1	Very high	95.2	Very high	11 Å²	11	70.6 Å²	70.6	6%	0.058	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-58.2	145.4	165.3	-68.4	-174	0	0	0	111.2	G408 I409 H413 R442 T443 Y446 S451 F456	G408-L438 CarbonylContact O-C 3.6Å; G408-L438 WeakPolarHBondContact O-CA 3.49Å; I409-L438 HydrophobicContact CB-CD2 3.83Å; I409-L438 HydrophobicContact CD1-CD2 3.83Å; I409-L438 HydrophobicContact CG1-CD2 3.6Å; H413-L438 HydrophobicContact CB-CD2 4.46Å; L438-R442 HydrophobicContact CB-CB 4.25Å; L438-R442 HydrophobicContact CD1-CB 4.4Å; L438-T443 WeakPolarHBondContact CB-OG1 3.26Å; L438-T443 PolarHBondContact O-OG1 3.33Å; L438-Y446 HydrophobicContact CD1-CD2 4.13Å; L438-Y446 HydrophobicContact CD1-CE2 3.74Å; L438-S451 PolarHBondContact N-O 3.34Å; L438-F456 HydrophobicContact CD1-CE2 4.03Å; L438-F456 HydrophobicContact CD1-CZ 4.08Å
439	S	95.4	Very high	94.8	Very high	40 Å²	40	74.2 Å²	74.2	28%	0.28	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-63.7	147.8	169.7	62.6	0	0	0	0	111	G408 E441 R442 T443	G408-S439 PolarHBondContact O-N 3.22Å; S439-E441 PolarHBondContact O-N 3.28Å; S439-R442 WeakPolarHBondContact O-CA 3.45Å; S439-R442 WeakPolarHBondContact O-CB 3.42Å; S439-R442 PolarHBondContact O-N 3.23Å; S439-T443 PolarHBondContact O-N 3.22Å; S439-T443 PolarHBondContact O-OG1 3.1Å
440	E	93.6	Very high	94.7	Very high	127 Å²	127	69.1 Å²	69.1	59%	0.593	34%	0.343	S	S	*	.	H	α-helix	trans	-40.4	-46.4	177	-87.7	-60.7	129.7	0	0	114.4	R442 T443 R444	E440-R442 PolarHBondContact O-N 3.32Å; E440-T443 PolarHBondContact O-N 2.9Å; E440-R444 WeakPolarHBondContact O-CG 3.38Å; E440-R444 PolarHBondContact O-N 3.32Å; E440-R444 PolarHBondContact O-NH1 2.96Å; E440-R444 IonicContact OE2-NH1 2.75Å; E440-R444 PolarHBondContact OE2-NH1 2.89Å
441	E	93.3	Very high	94.6	Very high	140 Å²	140	68.2 Å²	68.2	65%	0.654	34%	0.335	S	S	*	.	H	α-helix	trans	-60.9	-40.2	177.9	-64.4	174.2	174.9	0	0	113.3	S439	S439-E441 PolarHBondContact O-N 3.28Å
442	R	93.8	Very high	94.7	Very high	52 Å²	52	66.1 Å²	66.1	20%	0.196	31%	0.313	C	S	.	.	H	α-helix	trans	-77.6	-37	178.7	-69.2	-177.5	179.7	-77.1	-2.3	111.8	T375 T407 G408 L438 S439 E440 R444 L445	T375-R442 PolarHBondContact O-NH2 3.4Å; T407-R442 PolarHBondContact O-NE 3.01Å; T407-R442 PolarHBondContact O-NH2 3.03Å; G408-R442 WeakPolarHBondContact O-CD 3.46Å; L438-R442 HydrophobicContact CB-CB 4.25Å; L438-R442 HydrophobicContact CD1-CB 4.4Å; S439-R442 WeakPolarHBondContact O-CA 3.45Å; S439-R442 WeakPolarHBondContact O-CB 3.42Å; S439-R442 PolarHBondContact O-N 3.23Å; E440-R442 PolarHBondContact O-N 3.32Å; R442-R444 PolarHBondContact O-N 3.42Å; R442-L445 VanDerWaalsContact O-CB 3.27Å; R442-L445 WeakPolarHBondContact O-CB 3.43Å; R442-L445 PolarHBondContact O-N 3.07Å
443	T	94.2	Very high	94.7	Very high	13 Å²	13	65.5 Å²	65.5	8%	0.08	31%	0.311	C	S	.	.	H	α-helix	trans	-58.2	-30.4	173.5	-54.9	0	0	0	0	111.7	L438 S439 E440 L445 Y446 R449	L438-T443 WeakPolarHBondContact CB-OG1 3.26Å; L438-T443 PolarHBondContact O-OG1 3.33Å; S439-T443 PolarHBondContact O-N 3.22Å; S439-T443 PolarHBondContact O-OG1 3.1Å; E440-T443 PolarHBondContact O-N 2.9Å; T443-L445 VanDerWaalsContact C-N 3.29Å; T443-L445 PolarHBondContact O-N 2.94Å; T443-Y446 PolarHBondContact O-N 3.3Å; T443-R449 HydrophobicContact CG2-CB 3.91Å; T443-R449 VanDerWaalsContact CG2-O 3.31Å; T443-R449 WeakPolarHBondContact CG2-O 3.38Å; T443-R449 WeakPolarHBondContact O-CD 3.39Å
444	R	93.6	Very high	94.7	Very high	131 Å²	131	61.2 Å²	61.2	49%	0.494	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-13.3	174	-27.2	-162.8	-136.9	-75.4	-3.1	114.9	E440 R442 Y446	E440-R444 WeakPolarHBondContact O-CG 3.38Å; E440-R444 PolarHBondContact O-N 3.32Å; E440-R444 PolarHBondContact O-NH1 2.96Å; E440-R444 IonicContact OE2-NH1 2.75Å; E440-R444 PolarHBondContact OE2-NH1 2.89Å; R442-R444 PolarHBondContact O-N 3.42Å; R444-Y446 PolarHBondContact O-N 3.5Å
445	L	91.9	Very high	94.7	Very high	134 Å²	134	60.7 Å²	60.7	70%	0.702	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-14.8	177.3	-57.1	175.2	0	0	0	112.2	R442 T443	R442-L445 VanDerWaalsContact O-CB 3.27Å; R442-L445 WeakPolarHBondContact O-CB 3.43Å; R442-L445 PolarHBondContact O-N 3.07Å; T443-L445 VanDerWaalsContact C-N 3.29Å; T443-L445 PolarHBondContact O-N 2.94Å
446	Y	91.4	Very high	94.7	Very high	49 Å²	49	58.4 Å²	58.4	19%	0.192	27%	0.272	C	S	.	.	S	Bend	trans	-109.8	129.6	176.6	-58.2	-85	0	0	0	109.8	E417 L438 T443 R444 D448 R449 R450 F456	E417-Y446 PolarHBondContact OE1-OH 2.91Å; L438-Y446 HydrophobicContact CD1-CD2 4.13Å; L438-Y446 HydrophobicContact CD1-CE2 3.74Å; T443-Y446 PolarHBondContact O-N 3.3Å; R444-Y446 PolarHBondContact O-N 3.5Å; Y446-D448 WeakPolarHBondContact CB-OD1 3.18Å; Y446-D448 PolarHBondContact O-N 3.14Å; Y446-R449 PolarHBondContact O-N 3.42Å; Y446-R449 VanDerWaalsContact O-N 3.08Å; Y446-R450 HydrophobicContact CD1-CG 4.1Å; Y446-R450 HydrophobicContact CD2-CG 3.84Å; Y446-R450 HydrophobicContact CE2-CG 4.42Å; Y446-R450 HydrophobicContact CG-CG 3.66Å; Y446-F456 HydrophobicContact CD2-CZ 4.49Å; Y446-F456 AromaticContact CE1-CE1 3.78Å; Y446-F456 HydrophobicContact CE1-CE1 3.78Å; Y446-F456 HydrophobicContact CE1-CZ 4Å; Y446-F456 HydrophobicContact CE2-CE1 4.38Å; Y446-F456 AromaticContact CE2-CZ 3.77Å; Y446-F456 HydrophobicContact CE2-CZ 3.77Å; Y446-F456 AromaticContact CZ-CE1 3.64Å; Y446-F456 AromaticContact CZ-CZ 3.49Å; Y446-F456 VanDerWaalsContact CZ-CZ 3.49Å; Y446-F456 WeakPolarHBondContact OH-CZ 3.39Å
447	E	88.7	Confident	94.8	Very high	202 Å²	202	57.3 Å²	57.3	94%	0.944	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-37.2	-179.3	-62.8	-177.5	169.7	0	0	112.5	R449	E447-R449 VanDerWaalsContact C-N 3.31Å; E447-R449 PolarHBondContact O-N 2.91Å
448	D	88.7	Confident	94.8	Very high	35 Å²	35	52.5 Å²	52.5	19%	0.187	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	0.9	-178.6	62.4	2.8	0	0	0	114.5	Y446 R450 Y455 I459	Y446-D448 WeakPolarHBondContact CB-OD1 3.18Å; Y446-D448 PolarHBondContact O-N 3.14Å; D448-R450 PolarHBondContact O-N 2.88Å; D448-R450 IonicContact OD1-CZ 2.74Å; D448-R450 PolarHBondContact OD1-N 3.29Å; D448-R450 IonicContact OD1-NE 3.37Å; D448-R450 PolarHBondContact OD1-NE 2.7Å; D448-R450 IonicContact OD1-NH2 3.02Å; D448-R450 PolarHBondContact OD1-NH2 3.34Å; D448-R450 IonicContact OD2-CZ 2.77Å; D448-R450 IonicContact OD2-NE 2.76Å; D448-R450 PolarHBondContact OD2-NE 2.75Å; D448-R450 IonicContact OD2-NH2 2.71Å; D448-R450 PolarHBondContact OD2-NH2 3.27Å; D448-Y455 WeakPolarHBondContact CB-OH 3.36Å; D448-Y455 VanDerWaalsContact OD2-CE1 3.27Å; D448-Y455 WeakPolarHBondContact OD2-CE1 3.47Å; D448-Y455 PolarHBondContact OD2-OH 3.41Å; D448-I459 WeakPolarHBondContact OD2-CD1 3.41Å
449	R	90.9	Very high	94.8	Very high	110 Å²	110	53.6 Å²	53.6	42%	0.415	25%	0.247	S	C	.	.			trans	54.8	33.4	179	-53.2	-59	179.1	129.7	-1.9	113.7	T443 Y446 E447 M480	T443-R449 HydrophobicContact CG2-CB 3.91Å; T443-R449 VanDerWaalsContact CG2-O 3.31Å; T443-R449 WeakPolarHBondContact CG2-O 3.38Å; T443-R449 WeakPolarHBondContact O-CD 3.39Å; Y446-R449 PolarHBondContact O-N 3.42Å; Y446-R449 VanDerWaalsContact O-N 3.08Å; E447-R449 VanDerWaalsContact C-N 3.31Å; E447-R449 PolarHBondContact O-N 2.91Å; R449-M480 HydrophobicContact CB-CE 4.02Å; R449-M480 HydrophobicContact CG-CE 4.14Å
450	R	94.3	Very high	94.8	Very high	42 Å²	42	54.4 Å²	54.4	16%	0.158	25%	0.248	C	C	.	.			trans	-54.9	141.7	171.2	71	-171.9	70	171	3.9	111.7	Y446 D448 Y455 F456	Y446-R450 HydrophobicContact CD1-CG 4.1Å; Y446-R450 HydrophobicContact CD2-CG 3.84Å; Y446-R450 HydrophobicContact CE2-CG 4.42Å; Y446-R450 HydrophobicContact CG-CG 3.66Å; D448-R450 PolarHBondContact O-N 2.88Å; D448-R450 IonicContact OD1-CZ 2.74Å; D448-R450 PolarHBondContact OD1-N 3.29Å; D448-R450 IonicContact OD1-NE 3.37Å; D448-R450 PolarHBondContact OD1-NE 2.7Å; D448-R450 IonicContact OD1-NH2 3.02Å; D448-R450 PolarHBondContact OD1-NH2 3.34Å; D448-R450 IonicContact OD2-CZ 2.77Å; D448-R450 IonicContact OD2-NE 2.76Å; D448-R450 PolarHBondContact OD2-NE 2.75Å; D448-R450 IonicContact OD2-NH2 2.71Å; D448-R450 PolarHBondContact OD2-NH2 3.27Å; R450-Y455 HydrophobicContact CB-CD1 3.25Å; R450-Y455 HydrophobicContact CB-CD2 4.21Å; R450-Y455 HydrophobicContact CB-CE1 3.43Å; R450-Y455 VanDerWaalsContact CB-CE1 3.43Å; R450-Y455 HydrophobicContact CB-CE2 4.33Å; R450-Y455 HydrophobicContact CB-CG 3.69Å; R450-Y455 HydrophobicContact CG-CD1 4.24Å; R450-Y455 HydrophobicContact CG-CE1 4.41Å; R450-F456 VanDerWaalsContact CD-CE1 3.48Å; R450-F456 VanDerWaalsContact CD-CZ 3.41Å; R450-F456 HydrophobicContact CG-CE1 4.38Å; R450-F456 HydrophobicContact CG-CE2 3.97Å; R450-F456 HydrophobicContact CG-CZ 3.81Å
451	S	96.6	Very high	95	Very high	9 Å²	9	52.3 Å²	52.3	6%	0.063	24%	0.241	C	C	.	.			trans	-132.8	-31.5	-174.8	75.2	0	0	0	0	114.2	H413 Q437 L438 D479	H413-S451 PolarHBondContact NE2-O 2.88Å; Q437-S451 CarbonylContact C-O 3.59Å; Q437-S451 WeakPolarHBondContact CA-O 3.34Å; Q437-S451 PolarHBondContact NE2-OG 3.25Å; L438-S451 PolarHBondContact N-O 3.34Å; S451-D479 VanDerWaalsContact CA-OD1 3.3Å; S451-D479 WeakPolarHBondContact CA-OD1 3.44Å; S451-D479 WeakPolarHBondContact CB-OD1 3.4Å; S451-D479 PolarHBondContact N-OD1 3.46Å; S451-D479 PolarHBondContact OG-OD1 3.47Å
452	T	98.1	Very high	95.2	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.006	21%	0.214	C	C	.	.	S	Bend	trans	-100.1	154.2	-177.4	69.2	0	0	0	0	113.7	Q437 L454 Y455 F456 L478 D479	Q437-T452 HydrophobicContact CG-CG2 4.23Å; T452-L454 PolarHBondContact O-N 3.21Å; T452-Y455 WeakPolarHBondContact O-CB 3.35Å; T452-Y455 PolarHBondContact O-N 3.07Å; T452-Y455 PolarHBondContact OG1-N 3.15Å; T452-F456 VanDerWaalsContact O-CD2 3.25Å; T452-F456 WeakPolarHBondContact O-CD2 3.46Å; T452-F456 PolarHBondContact O-N 3.04Å; T452-L478 HydrophobicContact CG2-CB 3.77Å; T452-L478 HydrophobicContact CG2-CD1 4.05Å; T452-D479 WeakPolarHBondContact CB-OD2 3.25Å; T452-D479 VanDerWaalsContact CG2-OD2 3.28Å; T452-D479 WeakPolarHBondContact CG2-OD2 3.46Å; T452-D479 PolarHBondContact N-OD1 2.92Å; T452-D479 PolarHBondContact OG1-OD2 2.9Å
453	A	98.3	Very high	95.3	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.008	22%	0.216	C	C	.	.	H	α-helix	trans	-59.8	-32.4	170.2	0	0	0	0	0	112.8	L412 H413 A416 F456 A457 L469	L412-A453 HydrophobicContact CB-CB 3.99Å; H413-A453 PolarHBondContact CD2-N 3.31Å; H413-A453 PolarHBondContact NE2-N 3Å; A416-A453 HydrophobicContact CB-CB 4.5Å; A416-A453 WeakPolarHBondContact CB-O 3.31Å; A453-F456 WeakPolarHBondContact O-CB 3.43Å; A453-F456 PolarHBondContact O-N 3.09Å; A453-A457 PolarHBondContact O-N 2.76Å; A453-A457 VanDerWaalsContact O-N 3.08Å; A453-L469 HydrophobicContact CB-CD1 4.18Å; A453-L469 HydrophobicContact CB-CD2 4.32Å
454	L	98.6	Very high	95.5	Very high	2 Å²	2	49 Å²	49	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-62.6	-42.2	175.4	177.4	61.2	0	0	0	111.6	T452 F456 A457 V458 A466 L469 L470 A474 P476 P483 L499	T452-L454 PolarHBondContact O-N 3.21Å; L454-F456 VanDerWaalsContact C-N 3.31Å; L454-F456 PolarHBondContact O-N 3.4Å; L454-A457 PolarHBondContact O-N 2.89Å; L454-V458 HydrophobicContact CD1-CG2 4.12Å; L454-V458 HydrophobicContact CG-CG2 4.48Å; L454-V458 WeakPolarHBondContact O-CG2 3.18Å; L454-V458 PolarHBondContact O-N 3.44Å; L454-A466 HydrophobicContact CD1-CB 4.18Å; L454-L469 HydrophobicContact CB-CD1 4.41Å; L454-L469 HydrophobicContact CD1-CB 4.35Å; L454-L470 HydrophobicContact CD1-CD1 4.26Å; L454-L470 HydrophobicContact CD1-CD2 4.19Å; L454-L470 HydrophobicContact CD1-CG 3.9Å; L454-L470 HydrophobicContact CD2-CD2 3.61Å; L454-L470 HydrophobicContact CD2-CG 4.26Å; L454-A474 HydrophobicContact CB-CB 4.36Å; L454-A474 HydrophobicContact CD2-CB 4.14Å; L454-P476 HydrophobicContact CD2-CB 4.06Å; L454-P483 HydrophobicContact CD2-CG 4.49Å; L454-P483 HydrophobicContact CG-CG 4.38Å; L454-L499 HydrophobicContact CD1-CD2 4.46Å; L454-L499 HydrophobicContact CD2-CD2 4.16Å
455	Y	98.3	Very high	95.7	Very high	1 Å²	1	42.8 Å²	42.8	0%	0.004	21%	0.206	C	C	.	.	H	α-helix	trans	-58.5	-43.4	173.9	-169.9	-69.6	0	0	0	111.6	D448 R450 T452 V458 I459 D479 F481 P483 V486	D448-Y455 WeakPolarHBondContact CB-OH 3.36Å; D448-Y455 VanDerWaalsContact OD2-CE1 3.27Å; D448-Y455 WeakPolarHBondContact OD2-CE1 3.47Å; D448-Y455 PolarHBondContact OD2-OH 3.41Å; R450-Y455 HydrophobicContact CB-CD1 3.25Å; R450-Y455 HydrophobicContact CB-CD2 4.21Å; R450-Y455 HydrophobicContact CB-CE1 3.43Å; R450-Y455 VanDerWaalsContact CB-CE1 3.43Å; R450-Y455 HydrophobicContact CB-CE2 4.33Å; R450-Y455 HydrophobicContact CB-CG 3.69Å; R450-Y455 HydrophobicContact CG-CD1 4.24Å; R450-Y455 HydrophobicContact CG-CE1 4.41Å; T452-Y455 WeakPolarHBondContact O-CB 3.35Å; T452-Y455 PolarHBondContact O-N 3.07Å; T452-Y455 PolarHBondContact OG1-N 3.15Å; Y455-V458 PolarHBondContact O-N 2.97Å; Y455-I459 HydrophobicContact CD1-CB 4.36Å; Y455-I459 HydrophobicContact CD1-CG2 4.19Å; Y455-I459 HydrophobicContact CE1-CB 4.09Å; Y455-I459 HydrophobicContact CE1-CD1 3.89Å; Y455-I459 HydrophobicContact CE1-CG2 4.18Å; Y455-I459 WeakPolarHBondContact O-CG2 3.22Å; Y455-I459 PolarHBondContact O-N 3.27Å; Y455-D479 HydrophobicContact CD2-CB 4.02Å; Y455-F481 HydrophobicContact CE2-CD1 4.26Å; Y455-F481 VanDerWaalsContact CE2-O 3.23Å; Y455-F481 WeakPolarHBondContact CE2-O 3.32Å; Y455-P483 HydrophobicContact CD2-CG 4.33Å; Y455-V486 HydrophobicContact CD2-CG2 4.16Å; Y455-V486 HydrophobicContact CE1-CG2 4.34Å; Y455-V486 HydrophobicContact CE2-CG2 3.39Å
456	F	98.1	Very high	96.1	Very high	1 Å²	1	36.4 Å²	36.4	0%	0.004	17%	0.173	C	C	.	.	H	α-helix	trans	-60.4	-44.9	176.9	-77.6	-87.4	0	0	0	112.2	H413 A416 E417 L438 Y446 R450 T452 A453 L454 V458 N460	H413-F456 HydrophobicContact CB-CD2 4.33Å; H413-F456 HydrophobicContact CB-CE2 4.24Å; H413-F456 AromaticContact CD2-CD2 3.92Å; H413-F456 AromaticContact CD2-CE2 3.77Å; A416-F456 HydrophobicContact CB-CB 3.79Å; E417-F456 HydrophobicContact CB-CD1 3.67Å; E417-F456 HydrophobicContact CB-CE1 4.07Å; E417-F456 HydrophobicContact CB-CG 4.42Å; E417-F456 HydrophobicContact CG-CD1 3.95Å; E417-F456 HydrophobicContact CG-CE1 4.04Å; L438-F456 HydrophobicContact CD1-CE2 4.03Å; L438-F456 HydrophobicContact CD1-CZ 4.08Å; Y446-F456 HydrophobicContact CD2-CZ 4.49Å; Y446-F456 AromaticContact CE1-CE1 3.78Å; Y446-F456 HydrophobicContact CE1-CE1 3.78Å; Y446-F456 HydrophobicContact CE1-CZ 4Å; Y446-F456 HydrophobicContact CE2-CE1 4.38Å; Y446-F456 AromaticContact CE2-CZ 3.77Å; Y446-F456 HydrophobicContact CE2-CZ 3.77Å; Y446-F456 AromaticContact CZ-CE1 3.64Å; Y446-F456 AromaticContact CZ-CZ 3.49Å; Y446-F456 VanDerWaalsContact CZ-CZ 3.49Å; Y446-F456 WeakPolarHBondContact OH-CZ 3.39Å; R450-F456 VanDerWaalsContact CD-CE1 3.48Å; R450-F456 VanDerWaalsContact CD-CZ 3.41Å; R450-F456 HydrophobicContact CG-CE1 4.38Å; R450-F456 HydrophobicContact CG-CE2 3.97Å; R450-F456 HydrophobicContact CG-CZ 3.81Å; T452-F456 VanDerWaalsContact O-CD2 3.25Å; T452-F456 WeakPolarHBondContact O-CD2 3.46Å; T452-F456 PolarHBondContact O-N 3.04Å; A453-F456 WeakPolarHBondContact O-CB 3.43Å; A453-F456 PolarHBondContact O-N 3.09Å; L454-F456 VanDerWaalsContact C-N 3.31Å; L454-F456 PolarHBondContact O-N 3.4Å; F456-V458 PolarHBondContact O-N 2.83Å; F456-N460 VanDerWaalsContact O-CB 3.31Å; F456-N460 WeakPolarHBondContact O-CB 3.33Å; F456-N460 PolarHBondContact O-N 2.58Å; F456-N460 VanDerWaalsContact O-N 3.14Å
457	A	98.3	Very high	96.4	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-60.6	-45.4	175.8	0	0	0	0	0	111.7	A416 A453 L454 N460 N461 N462 A465 A466 L469	A416-A457 HydrophobicContact CB-CB 4.49Å; A453-A457 PolarHBondContact O-N 2.76Å; A453-A457 VanDerWaalsContact O-N 3.08Å; L454-A457 PolarHBondContact O-N 2.89Å; A457-N460 PolarHBondContact O-N 3.48Å; A457-N461 PolarHBondContact O-N 2.76Å; A457-N462 PolarHBondContact O-N 2.95Å; A457-A465 HydrophobicContact CB-CB 3.7Å; A457-A466 HydrophobicContact CB-CB 4.27Å; A457-L469 HydrophobicContact CB-CD1 4.15Å
458	V	98	Very high	96.9	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.006	15%	0.146	C	C	.	.	H	α-helix	trans	-66.3	-45.6	-178.2	168.8	0	0	0	0	112.6	L454 Y455 F456 N460 N461 A466 P483 V486 A487 I495 L499	L454-V458 HydrophobicContact CD1-CG2 4.12Å; L454-V458 HydrophobicContact CG-CG2 4.48Å; L454-V458 WeakPolarHBondContact O-CG2 3.18Å; L454-V458 PolarHBondContact O-N 3.44Å; Y455-V458 PolarHBondContact O-N 2.97Å; F456-V458 PolarHBondContact O-N 2.83Å; V458-N460 VanDerWaalsContact C-N 3.28Å; V458-N460 PolarHBondContact O-N 3.14Å; V458-N461 PolarHBondContact O-N 2.87Å; V458-A466 HydrophobicContact CG2-CB 4.28Å; V458-P483 HydrophobicContact CB-CB 4.27Å; V458-P483 HydrophobicContact CG1-CB 4.23Å; V458-P483 WeakPolarHBondContact CG1-O 3.4Å; V458-P483 HydrophobicContact CG2-CB 4.06Å; V458-V486 HydrophobicContact CG1-CB 4.11Å; V458-V486 HydrophobicContact CG1-CG1 4.14Å; V458-A487 HydrophobicContact CG1-CB 3.91Å; V458-I495 HydrophobicContact CB-CG2 4.35Å; V458-I495 HydrophobicContact CG1-CG2 3.99Å; V458-I495 HydrophobicContact CG2-CG2 3.71Å; V458-L499 HydrophobicContact CG2-CD1 4.3Å
459	I	96.7	Very high	97.3	Very high	35 Å²	35	29.6 Å²	29.6	18%	0.179	14%	0.137	C	C	.	.	H	α-helix	trans	-70.7	-25.5	179.4	-161.5	167.8	0	0	0	112.9	D448 Y455 N461 V486 M490	D448-I459 WeakPolarHBondContact OD2-CD1 3.41Å; Y455-I459 HydrophobicContact CD1-CB 4.36Å; Y455-I459 HydrophobicContact CD1-CG2 4.19Å; Y455-I459 HydrophobicContact CE1-CB 4.09Å; Y455-I459 HydrophobicContact CE1-CD1 3.89Å; Y455-I459 HydrophobicContact CE1-CG2 4.18Å; Y455-I459 WeakPolarHBondContact O-CG2 3.22Å; Y455-I459 PolarHBondContact O-N 3.27Å; I459-N461 PolarHBondContact O-N 3.14Å; I459-V486 HydrophobicContact CB-CG1 3.98Å; I459-V486 HydrophobicContact CD1-CG1 4.44Å; I459-V486 HydrophobicContact CG1-CG1 4Å; I459-M490 HydrophobicContact CG1-SD 4.39Å; I459-M490 VanDerWaalsContact O-CE 3.32Å; I459-M490 WeakPolarHBondContact O-CE 3.31Å
460	N	96.1	Very high	97.7	Very high	56 Å²	56	24.6 Å²	24.6	30%	0.299	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-1.3	170.2	-77	0.1	0	0	0	113.3	A416 E417 N419 F456 A457 V458 N462	A416-N460 PolarHBondContact O-ND2 3.21Å; E417-N460 VanDerWaalsContact C-ND2 3.35Å; E417-N460 PolarHBondContact O-ND2 3.34Å; N419-N460 WeakPolarHBondContact OD1-CB 3.36Å; N419-N460 PolarHBondContact OD1-ND2 3.27Å; N419-N460 VanDerWaalsContact OD1-ND2 3.07Å; F456-N460 VanDerWaalsContact O-CB 3.31Å; F456-N460 WeakPolarHBondContact O-CB 3.33Å; F456-N460 PolarHBondContact O-N 2.58Å; F456-N460 VanDerWaalsContact O-N 3.14Å; A457-N460 PolarHBondContact O-N 3.48Å; V458-N460 VanDerWaalsContact C-N 3.28Å; V458-N460 PolarHBondContact O-N 3.14Å; N460-N462 HydrophobicContact CB-CB 4.49Å; N460-N462 PolarHBondContact O-N 3.34Å
461	N	96.9	Very high	97.9	Very high	84 Å²	84	26.3 Å²	26.3	45%	0.449	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.3	30.7	-170.7	-167.9	41.8	0	0	0	113.7	A457 V458 I459 T463 M490 C492 I495	A457-N461 PolarHBondContact O-N 2.76Å; V458-N461 PolarHBondContact O-N 2.87Å; I459-N461 PolarHBondContact O-N 3.14Å; N461-T463 PolarHBondContact O-N 2.88Å; N461-M490 HydrophobicContact CB-CE 3.86Å; N461-C492 PolarHBondContact OD1-SG 3Å; N461-I495 WeakPolarHBondContact OD1-CD1 3Å
462	N	97.5	Very high	98	Very high	17 Å²	17	28 Å²	28	9%	0.091	16%	0.156	C	C	.	.			trans	-87.5	93.8	177.8	-172.1	-20.2	0	0	0	109.4	N419 D421 A457 N460 E464 A465 A466	N419-N462 PolarHBondContact OD1-ND2 3.4Å; D421-N462 PolarHBondContact OD1-ND2 3.21Å; D421-N462 PolarHBondContact OD2-ND2 3.26Å; A457-N462 PolarHBondContact O-N 2.95Å; N460-N462 HydrophobicContact CB-CB 4.49Å; N460-N462 PolarHBondContact O-N 3.34Å; N462-E464 VanDerWaalsContact C-N 3.3Å; N462-E464 PolarHBondContact O-N 3.4Å; N462-E464 PolarHBondContact OD1-N 3.11Å; N462-A465 HydrophobicContact CB-CB 4.02Å; N462-A465 WeakPolarHBondContact ND2-CB 3.4Å; N462-A465 WeakPolarHBondContact OD1-CB 3.48Å; N462-A465 PolarHBondContact OD1-N 3.49Å; N462-A466 WeakPolarHBondContact O-CB 3.39Å; N462-A466 PolarHBondContact O-N 3.01Å; N462-A466 VanDerWaalsContact O-N 3.1Å
463	T	97.4	Very high	97.9	Very high	39 Å²	39	30.1 Å²	30.1	24%	0.239	18%	0.178	C	C	.	.	H	α-helix	trans	-61.7	-34.5	179.6	20.2	0	0	0	0	113.2	N461 R467 Q494 I495	N461-T463 PolarHBondContact O-N 2.88Å; T463-R467 WeakPolarHBondContact O-CB 3.35Å; T463-R467 PolarHBondContact O-N 3.4Å; T463-Q494 HydrophobicContact CG2-CB 4.04Å; T463-I495 HydrophobicContact CG2-CD1 4.1Å; T463-I495 HydrophobicContact CG2-CG1 3.45Å; T463-I495 VanDerWaalsContact CG2-CG1 3.45Å
464	E	97.8	Very high	97.9	Very high	80 Å²	80	30.3 Å²	30.3	37%	0.374	18%	0.18	S	C	.	.	H	α-helix	trans	-81.9	-42.4	-174.6	-157.1	53.3	-138.7	0	0	111.5	N462 A466 R467 M468	N462-E464 VanDerWaalsContact C-N 3.3Å; N462-E464 PolarHBondContact O-N 3.4Å; N462-E464 PolarHBondContact OD1-N 3.11Å; E464-A466 VanDerWaalsContact C-N 3.27Å; E464-A466 PolarHBondContact O-N 3.2Å; E464-R467 VanDerWaalsContact CD-NE 3.29Å; E464-R467 WeakPolarHBondContact O-CB 3.37Å; E464-R467 PolarHBondContact O-N 3.26Å; E464-R467 VanDerWaalsContact O-N 3.1Å; E464-R467 VanDerWaalsContact OE1-CD 3.25Å; E464-R467 WeakPolarHBondContact OE1-CD 3.49Å; E464-R467 IonicContact OE1-NE 3.07Å; E464-R467 PolarHBondContact OE1-NE 3.07Å; E464-R467 IonicContact OE2-CZ 3.63Å; E464-R467 IonicContact OE2-NE 3.79Å; E464-R467 PolarHBondContact OE2-NE 3.08Å; E464-R467 IonicContact OE2-NH2 3.59Å; E464-R467 PolarHBondContact OE2-NH2 2.98Å; E464-M468 WeakPolarHBondContact O-CG 3.43Å; E464-M468 PolarHBondContact O-N 3.05Å
465	A	98.3	Very high	97.9	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-56.4	-41.9	167.9	0	0	0	0	0	112.2	L424 A457 N462 L469	L424-A465 HydrophobicContact CD2-CB 3.51Å; A457-A465 HydrophobicContact CB-CB 3.7Å; N462-A465 HydrophobicContact CB-CB 4.02Å; N462-A465 WeakPolarHBondContact ND2-CB 3.4Å; N462-A465 WeakPolarHBondContact OD1-CB 3.48Å; N462-A465 PolarHBondContact OD1-N 3.49Å; A465-L469 WeakPolarHBondContact O-CB 3.31Å; A465-L469 WeakPolarHBondContact O-CD1 3.23Å; A465-L469 VanDerWaalsContact O-CG 3.28Å; A465-L469 WeakPolarHBondContact O-CG 3.41Å; A465-L469 PolarHBondContact O-N 3.4Å
466	A	98.4	Very high	97.9	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.9	-41.4	175.3	0	0	0	0	0	112	L454 A457 V458 N462 E464 L470 L498	L454-A466 HydrophobicContact CD1-CB 4.18Å; A457-A466 HydrophobicContact CB-CB 4.27Å; V458-A466 HydrophobicContact CG2-CB 4.28Å; N462-A466 WeakPolarHBondContact O-CB 3.39Å; N462-A466 PolarHBondContact O-N 3.01Å; N462-A466 VanDerWaalsContact O-N 3.1Å; E464-A466 VanDerWaalsContact C-N 3.27Å; E464-A466 PolarHBondContact O-N 3.2Å; A466-L470 WeakPolarHBondContact O-CB 3.27Å; A466-L470 WeakPolarHBondContact O-CD1 3.45Å; A466-L470 WeakPolarHBondContact O-CG 3.27Å; A466-L470 PolarHBondContact O-N 3.47Å; A466-L498 HydrophobicContact CB-CD2 4.24Å
467	R	98.6	Very high	97.8	Very high	111 Å²	111	34.9 Å²	34.9	42%	0.419	21%	0.205	S	C	.	.	H	α-helix	trans	-61.7	-50.6	175.6	-170.3	-161.5	-45.4	-67	-7.5	111.8	T463 E464 L469 L470 A471 L498	T463-R467 WeakPolarHBondContact O-CB 3.35Å; T463-R467 PolarHBondContact O-N 3.4Å; E464-R467 VanDerWaalsContact CD-NE 3.29Å; E464-R467 WeakPolarHBondContact O-CB 3.37Å; E464-R467 PolarHBondContact O-N 3.26Å; E464-R467 VanDerWaalsContact O-N 3.1Å; E464-R467 VanDerWaalsContact OE1-CD 3.25Å; E464-R467 WeakPolarHBondContact OE1-CD 3.49Å; E464-R467 IonicContact OE1-NE 3.07Å; E464-R467 PolarHBondContact OE1-NE 3.07Å; E464-R467 IonicContact OE2-CZ 3.63Å; E464-R467 IonicContact OE2-NE 3.79Å; E464-R467 PolarHBondContact OE2-NE 3.08Å; E464-R467 IonicContact OE2-NH2 3.59Å; E464-R467 PolarHBondContact OE2-NH2 2.98Å; R467-L469 VanDerWaalsContact C-N 3.33Å; R467-L469 PolarHBondContact O-N 3.2Å; R467-L470 PolarHBondContact O-N 3.4Å; R467-A471 VanDerWaalsContact O-CB 3.25Å; R467-A471 WeakPolarHBondContact O-CB 3.18Å; R467-A471 PolarHBondContact O-N 3.16Å; R467-L498 HydrophobicContact CB-CD2 4.11Å; R467-L498 HydrophobicContact CG-CD1 4.36Å
468	M	98.5	Very high	97.7	Very high	31 Å²	31	37.7 Å²	37.7	15%	0.153	22%	0.219	C	C	.	.	H	α-helix	trans	-59.9	-44	-179.5	-69.9	-171.1	-75.3	0	0	111.6	D421 L424 E425 I428 E464 A472	D421-M468 HydrophobicContact CB-CE 3.82Å; L424-M468 HydrophobicContact CD2-CE 4.24Å; E425-M468 HydrophobicContact CB-SD 3.84Å; E425-M468 HydrophobicContact CG-SD 4.24Å; I428-M468 HydrophobicContact CD1-CB 3.95Å; E464-M468 WeakPolarHBondContact O-CG 3.43Å; E464-M468 PolarHBondContact O-N 3.05Å; M468-A472 VanDerWaalsContact O-CB 3.25Å; M468-A472 WeakPolarHBondContact O-CB 3.27Å; M468-A472 PolarHBondContact O-N 3.44Å
469	L	98.6	Very high	97.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64.2	-45.4	177.4	-73	167.1	0	0	0	112.3	L424 I428 V434 A453 L454 A457 A465 R467 A472 G473 A474	L424-L469 HydrophobicContact CD1-CD2 4.46Å; L424-L469 HydrophobicContact CD2-CD1 4.12Å; L424-L469 HydrophobicContact CD2-CG 4.04Å; I428-L469 HydrophobicContact CD1-CD2 4.02Å; I428-L469 HydrophobicContact CD1-CG 4.36Å; I428-L469 HydrophobicContact CG1-CD2 4.47Å; V434-L469 HydrophobicContact CB-CD2 4.09Å; V434-L469 HydrophobicContact CG1-CD2 3.93Å; A453-L469 HydrophobicContact CB-CD1 4.18Å; A453-L469 HydrophobicContact CB-CD2 4.32Å; L454-L469 HydrophobicContact CB-CD1 4.41Å; L454-L469 HydrophobicContact CD1-CB 4.35Å; A457-L469 HydrophobicContact CB-CD1 4.15Å; A465-L469 WeakPolarHBondContact O-CB 3.31Å; A465-L469 WeakPolarHBondContact O-CD1 3.23Å; A465-L469 VanDerWaalsContact O-CG 3.28Å; A465-L469 WeakPolarHBondContact O-CG 3.41Å; A465-L469 PolarHBondContact O-N 3.4Å; R467-L469 VanDerWaalsContact C-N 3.33Å; R467-L469 PolarHBondContact O-N 3.2Å; L469-A472 CarbonylContact O-C 3.37Å; L469-A472 PolarHBondContact O-N 2.88Å; L469-G473 PolarHBondContact O-N 3.4Å; L469-A474 HydrophobicContact CB-CB 4.01Å; L469-A474 WeakPolarHBondContact O-CB 3.23Å; L469-A474 PolarHBondContact O-N 2.88Å
470	L	98.4	Very high	97.1	Very high	6 Å²	6	40.3 Å²	40.3	3%	0.031	23%	0.232	C	C	.	.	H	α-helix	trans	-67.4	-41.8	179.3	-71.6	168.2	0	0	0	112.2	L454 A466 R467 A472 G473 A474 P476 L498 L499 H502	L454-L470 HydrophobicContact CD1-CD1 4.26Å; L454-L470 HydrophobicContact CD1-CD2 4.19Å; L454-L470 HydrophobicContact CD1-CG 3.9Å; L454-L470 HydrophobicContact CD2-CD2 3.61Å; L454-L470 HydrophobicContact CD2-CG 4.26Å; A466-L470 WeakPolarHBondContact O-CB 3.27Å; A466-L470 WeakPolarHBondContact O-CD1 3.45Å; A466-L470 WeakPolarHBondContact O-CG 3.27Å; A466-L470 PolarHBondContact O-N 3.47Å; R467-L470 PolarHBondContact O-N 3.4Å; L470-A472 PolarHBondContact O-N 3.01Å; L470-G473 PolarHBondContact O-N 3.03Å; L470-A474 WeakPolarHBondContact CD2-O 3.32Å; L470-P476 HydrophobicContact CD2-CB 4.35Å; L470-P476 HydrophobicContact CD2-CG 4.49Å; L470-L498 HydrophobicContact CD1-CD2 3.87Å; L470-L498 HydrophobicContact CD1-CG 3.67Å; L470-L499 HydrophobicContact CD1-CD2 3.98Å; L470-L499 HydrophobicContact CD1-CG 4.49Å; L470-L499 HydrophobicContact CD2-CD2 4.29Å; L470-H502 HydrophobicContact CB-CB 4.36Å; L470-H502 HydrophobicContact CD2-CB 3.91Å; L470-H502 HydrophobicContact CG-CB 4.49Å
471	A	98.2	Very high	96.9	Very high	78 Å²	78	39.1 Å²	39.1	65%	0.645	22%	0.224	S	C	*	.	H	α-helix	trans	-62.6	-30.1	173.7	0	0	0	0	0	112.5	R467 G473	R467-A471 VanDerWaalsContact O-CB 3.25Å; R467-A471 WeakPolarHBondContact O-CB 3.18Å; R467-A471 PolarHBondContact O-N 3.16Å; A471-G473 VanDerWaalsContact C-N 3.27Å; A471-G473 PolarHBondContact O-N 3.01Å
472	A	98.2	Very high	96.8	Very high	44 Å²	44	37.8 Å²	37.8	36%	0.364	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	4.2	172.7	0	0	0	0	0	114.4	I428 V434 M468 L469 L470	I428-A472 HydrophobicContact CD1-CB 4.46Å; I428-A472 HydrophobicContact CG1-CB 4.49Å; I428-A472 HydrophobicContact CG2-CB 3.52Å; V434-A472 HydrophobicContact CG1-CB 3.98Å; M468-A472 VanDerWaalsContact O-CB 3.25Å; M468-A472 WeakPolarHBondContact O-CB 3.27Å; M468-A472 PolarHBondContact O-N 3.44Å; L469-A472 CarbonylContact O-C 3.37Å; L469-A472 PolarHBondContact O-N 2.88Å; L470-A472 PolarHBondContact O-N 3.01Å
473	G	97.8	Very high	96.7	Very high	45 Å²	45	37 Å²	37	46%	0.464	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.2	27.5	176.8	0	0	0	0	0	115.2	N435 L469 L470 A471 D475	N435-G473 PolarHBondContact ND2-O 3.19Å; L469-G473 PolarHBondContact O-N 3.4Å; L470-G473 PolarHBondContact O-N 3.03Å; A471-G473 VanDerWaalsContact C-N 3.27Å; A471-G473 PolarHBondContact O-N 3.01Å; G473-D475 PolarHBondContact O-N 2.98Å
474	A	98.3	Very high	96.7	Very high	6 Å²	6	35.2 Å²	35.2	5%	0.05	20%	0.198	C	C	.	.			trans	-64.7	130	167.6	0	0	0	0	0	110.8	V434 N435 L454 L469 L470 P476	V434-A474 HydrophobicContact CB-CB 4.3Å; V434-A474 HydrophobicContact CG2-CB 4.13Å; N435-A474 VanDerWaalsContact OD1-CA 3.3Å; N435-A474 WeakPolarHBondContact OD1-CA 3.46Å; L454-A474 HydrophobicContact CB-CB 4.36Å; L454-A474 HydrophobicContact CD2-CB 4.14Å; L469-A474 HydrophobicContact CB-CB 4.01Å; L469-A474 WeakPolarHBondContact O-CB 3.23Å; L469-A474 PolarHBondContact O-N 2.88Å; L470-A474 WeakPolarHBondContact CD2-O 3.32Å; A474-P476 WeakPolarHBondContact O-CD 3.49Å
475	D	97.9	Very high	96.6	Very high	60 Å²	60	31.5 Å²	31.5	32%	0.321	18%	0.18	S	C	.	.			trans	-84.1	116.2	176.8	175.3	9.1	0	0	0	110	N435 G473 N477 L478	N435-D475 PolarHBondContact OD1-N 3.07Å; G473-D475 PolarHBondContact O-N 2.98Å; D475-N477 PolarHBondContact O-N 3.43Å; D475-N477 WeakPolarHBondContact OD1-CB 3.23Å; D475-N477 PolarHBondContact OD1-N 2.91Å; D475-N477 PolarHBondContact OD1-ND2 3.35Å; D475-L478 HydrophobicContact CB-CD1 4.06Å; D475-L478 HydrophobicContact CB-CD2 4.38Å; D475-L478 HydrophobicContact CB-CG 3.88Å; D475-L478 WeakPolarHBondContact OD2-CD2 3.35Å
476	P	97.6	Very high	96.4	Very high	3 Å²	3	31.5 Å²	31.5	2%	0.019	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	6.1	179.4	31.2	-36.8	0	0	0	114.7	L454 L470 A474 P483 L499 A504	L454-P476 HydrophobicContact CD2-CB 4.06Å; L470-P476 HydrophobicContact CD2-CB 4.35Å; L470-P476 HydrophobicContact CD2-CG 4.49Å; A474-P476 WeakPolarHBondContact O-CD 3.49Å; P476-P483 WeakPolarHBondContact O-CD 3.14Å; P476-L499 HydrophobicContact CB-CD2 3.69Å; P476-A504 HydrophobicContact CB-CB 3.82Å; P476-A504 HydrophobicContact CG-CB 3.8Å
477	N	96.4	Very high	96.3	Very high	37 Å²	37	31.5 Å²	31.5	20%	0.198	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.8	-4.5	-172.4	-59.3	-69	0	0	0	115.6	D475 R482 G503 D505	D475-N477 PolarHBondContact O-N 3.43Å; D475-N477 WeakPolarHBondContact OD1-CB 3.23Å; D475-N477 PolarHBondContact OD1-N 2.91Å; D475-N477 PolarHBondContact OD1-ND2 3.35Å; N477-R482 PolarHBondContact OD1-NH1 3.36Å; N477-G503 PolarHBondContact ND2-O 3.45Å; N477-D505 WeakPolarHBondContact OD1-CB 3.36Å; N477-D505 PolarHBondContact OD1-N 2.8Å
478	L	95.4	Very high	96.2	Very high	58 Å²	58	26.4 Å²	26.4	30%	0.304	16%	0.161	S	C	.	.			trans	-72.4	-30.9	-171.8	-62.9	175.7	0	0	0	114.8	N435 Q437 T452 D475	N435-L478 HydrophobicContact CB-CD1 3.77Å; N435-L478 WeakPolarHBondContact OD1-CD1 3.33Å; Q437-L478 PolarHBondContact NE2-O 3.05Å; T452-L478 HydrophobicContact CG2-CB 3.77Å; T452-L478 HydrophobicContact CG2-CD1 4.05Å; D475-L478 HydrophobicContact CB-CD1 4.06Å; D475-L478 HydrophobicContact CB-CD2 4.38Å; D475-L478 HydrophobicContact CB-CG 3.88Å; D475-L478 WeakPolarHBondContact OD2-CD2 3.35Å
479	D	94.3	Very high	95.9	Very high	3 Å²	3	31.3 Å²	31.3	2%	0.016	18%	0.178	C	C	.	.	S	Bend	trans	-77.7	137.6	-179.8	-63.3	-81.8	0	0	0	112.3	S451 T452 Y455 F481 R482	S451-D479 VanDerWaalsContact CA-OD1 3.3Å; S451-D479 WeakPolarHBondContact CA-OD1 3.44Å; S451-D479 WeakPolarHBondContact CB-OD1 3.4Å; S451-D479 PolarHBondContact N-OD1 3.46Å; S451-D479 PolarHBondContact OG-OD1 3.47Å; T452-D479 WeakPolarHBondContact CB-OD2 3.25Å; T452-D479 VanDerWaalsContact CG2-OD2 3.28Å; T452-D479 WeakPolarHBondContact CG2-OD2 3.46Å; T452-D479 PolarHBondContact N-OD1 2.92Å; T452-D479 PolarHBondContact OG1-OD2 2.9Å; Y455-D479 HydrophobicContact CD2-CB 4.02Å; D479-F481 WeakPolarHBondContact CB-O 3.42Å; D479-F481 CarbonylContact O-C 3.57Å; D479-F481 PolarHBondContact O-N 3.31Å; D479-R482 WeakPolarHBondContact O-CG 3.45Å
480	M	88.5	Confident	95.6	Very high	88 Å²	88	34.8 Å²	34.8	43%	0.433	20%	0.195	S	C	.	.	S	Bend	trans	-54.4	-38.9	177.1	-178.4	-172.5	67.6	0	0	112.6	R449 P511 T512	R449-M480 HydrophobicContact CB-CE 4.02Å; R449-M480 HydrophobicContact CG-CE 4.14Å; M480-P511 HydrophobicContact CG-CG 4.09Å; M480-T512 HydrophobicContact CE-CG2 4.41Å; M480-T512 HydrophobicContact SD-CG2 4.36Å
481	F	91.9	Very high	95.2	Very high	31 Å²	31	36.4 Å²	36.4	14%	0.136	21%	0.214	C	C	.	.	S	Bend	trans	-104.5	108.6	165.7	-168.5	-103.3	0	0	0	107.3	Y455 D479 M485 V486 I510 F523	Y455-F481 HydrophobicContact CE2-CD1 4.26Å; Y455-F481 VanDerWaalsContact CE2-O 3.23Å; Y455-F481 WeakPolarHBondContact CE2-O 3.32Å; D479-F481 WeakPolarHBondContact CB-O 3.42Å; D479-F481 CarbonylContact O-C 3.57Å; D479-F481 PolarHBondContact O-N 3.31Å; F481-M485 HydrophobicContact CD2-SD 4.18Å; F481-M485 HydrophobicContact CE1-CB 3.94Å; F481-M485 HydrophobicContact CE2-CB 4.06Å; F481-M485 HydrophobicContact CE2-SD 4.04Å; F481-M485 HydrophobicContact CZ-CB 3.67Å; F481-V486 HydrophobicContact CD1-CG2 3.59Å; F481-V486 HydrophobicContact CE1-CB 4.49Å; F481-V486 HydrophobicContact CE1-CG2 3.6Å; F481-I510 HydrophobicContact CD2-CD1 4.16Å; F481-I510 HydrophobicContact CD2-CG1 4.17Å; F481-I510 HydrophobicContact CE2-CD1 3.71Å; F481-I510 HydrophobicContact CE2-CG1 4.19Å; F481-F523 HydrophobicContact CE2-CE2 4.09Å; F481-F523 AromaticContact CE2-CZ 3.98Å; F481-F523 HydrophobicContact CE2-CZ 3.98Å; F481-F523 AromaticContact CZ-CE2 3.89Å; F481-F523 HydrophobicContact CZ-CE2 3.89Å; F481-F523 AromaticContact CZ-CZ 3.79Å; F481-F523 HydrophobicContact CZ-CZ 3.79Å
482	R	94.1	Very high	94.9	Very high	56 Å²	56	33.6 Å²	33.6	21%	0.211	19%	0.189	C	C	.	.			trans	-72.2	143.7	-165.5	-64.9	-174.5	-173.7	-163.1	10.8	112.1	N477 D479 L484 M485 V486 D505	N477-R482 PolarHBondContact OD1-NH1 3.36Å; D479-R482 WeakPolarHBondContact O-CG 3.45Å; R482-L484 PolarHBondContact O-N 3.26Å; R482-M485 HydrophobicContact CB-CG 4.48Å; R482-M485 WeakPolarHBondContact O-CB 3.41Å; R482-M485 PolarHBondContact O-N 2.89Å; R482-V486 PolarHBondContact O-N 2.71Å; R482-D505 IonicContact CZ-OD2 2.72Å; R482-D505 IonicContact NH1-OD2 3.19Å; R482-D505 PolarHBondContact NH1-OD2 3.25Å; R482-D505 IonicContact NH2-OD2 2.8Å
483	P	96.8	Very high	94.6	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-48.2	-34.5	173.3	-29.1	33.5	0	0	0	114	L454 Y455 V458 P476 M485 V486 A487 L499	L454-P483 HydrophobicContact CD2-CG 4.49Å; L454-P483 HydrophobicContact CG-CG 4.38Å; Y455-P483 HydrophobicContact CD2-CG 4.33Å; V458-P483 HydrophobicContact CB-CB 4.27Å; V458-P483 HydrophobicContact CG1-CB 4.23Å; V458-P483 WeakPolarHBondContact CG1-O 3.4Å; V458-P483 HydrophobicContact CG2-CB 4.06Å; P476-P483 WeakPolarHBondContact O-CD 3.14Å; P483-M485 VanDerWaalsContact C-N 3.34Å; P483-M485 PolarHBondContact O-N 3.21Å; P483-V486 WeakPolarHBondContact O-CB 3.14Å; P483-V486 PolarHBondContact O-N 3.36Å; P483-A487 WeakPolarHBondContact O-CB 3.5Å; P483-A487 PolarHBondContact O-N 3.2Å; P483-L499 HydrophobicContact CB-CD1 4.11Å; P483-L499 HydrophobicContact CB-CD2 4.16Å
484	L	97	Very high	94.5	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.01	20%	0.196	C	C	.	.	H	α-helix	trans	-58.2	-43.1	174.9	-178.9	62.7	0	0	0	112.7	R482 A487 S488 V496 L499 V500 A504 I506 V520 L534	R482-L484 PolarHBondContact O-N 3.26Å; L484-A487 PolarHBondContact O-N 3.22Å; L484-S488 WeakPolarHBondContact O-CB 3.42Å; L484-S488 PolarHBondContact O-N 3.16Å; L484-S488 PolarHBondContact O-OG 3.28Å; L484-V496 HydrophobicContact CD1-CB 4.38Å; L484-V496 HydrophobicContact CD1-CG1 3.67Å; L484-V496 HydrophobicContact CD1-CG2 4.47Å; L484-L499 HydrophobicContact CB-CD1 4.43Å; L484-L499 HydrophobicContact CD1-CB 4.35Å; L484-V500 HydrophobicContact CD1-CG2 3.92Å; L484-A504 HydrophobicContact CB-CB 4.11Å; L484-A504 HydrophobicContact CD2-CB 4.01Å; L484-A504 HydrophobicContact CG-CB 4.44Å; L484-I506 HydrophobicContact CD2-CB 4.47Å; L484-I506 HydrophobicContact CD2-CG1 4.07Å; L484-V520 HydrophobicContact CD2-CG2 4.42Å; L484-V520 HydrophobicContact CG-CG2 4.06Å; L484-L534 HydrophobicContact CD1-CD2 4.34Å
485	M	95	Very high	94.4	Very high	3 Å²	3	38.6 Å²	38.6	2%	0.015	19%	0.193	C	C	.	.	H	α-helix	trans	-68.2	-37	177.8	-57.7	-179.7	-171.8	0	0	111.5	F481 R482 P483 R489 A508 I510 A519 V520 F523	F481-M485 HydrophobicContact CD2-SD 4.18Å; F481-M485 HydrophobicContact CE1-CB 3.94Å; F481-M485 HydrophobicContact CE2-CB 4.06Å; F481-M485 HydrophobicContact CE2-SD 4.04Å; F481-M485 HydrophobicContact CZ-CB 3.67Å; R482-M485 HydrophobicContact CB-CG 4.48Å; R482-M485 WeakPolarHBondContact O-CB 3.41Å; R482-M485 PolarHBondContact O-N 2.89Å; P483-M485 VanDerWaalsContact C-N 3.34Å; P483-M485 PolarHBondContact O-N 3.21Å; M485-R489 VanDerWaalsContact O-CB 3.3Å; M485-R489 WeakPolarHBondContact O-CB 3.38Å; M485-R489 PolarHBondContact O-N 2.77Å; M485-A508 HydrophobicContact CE-CB 3.64Å; M485-A508 WeakPolarHBondContact CE-O 3.31Å; M485-I510 HydrophobicContact CE-CG1 4.11Å; M485-I510 HydrophobicContact SD-CD1 3.97Å; M485-I510 HydrophobicContact SD-CG1 3.53Å; M485-I510 VanDerWaalsContact SD-CG1 3.53Å; M485-A519 HydrophobicContact CE-CB 3.94Å; M485-A519 HydrophobicContact SD-CB 4.33Å; M485-V520 HydrophobicContact CG-CB 4.37Å; M485-F523 HydrophobicContact CB-CD2 4.07Å; M485-F523 HydrophobicContact CB-CE2 3.93Å; M485-F523 HydrophobicContact CG-CE2 4.43Å
486	V	95.1	Very high	94.4	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62.1	-52.9	174	-176.7	0	0	0	0	110.5	Y455 V458 I459 F481 R482 P483 S488 R489 M490	Y455-V486 HydrophobicContact CD2-CG2 4.16Å; Y455-V486 HydrophobicContact CE1-CG2 4.34Å; Y455-V486 HydrophobicContact CE2-CG2 3.39Å; V458-V486 HydrophobicContact CG1-CB 4.11Å; V458-V486 HydrophobicContact CG1-CG1 4.14Å; I459-V486 HydrophobicContact CB-CG1 3.98Å; I459-V486 HydrophobicContact CD1-CG1 4.44Å; I459-V486 HydrophobicContact CG1-CG1 4Å; F481-V486 HydrophobicContact CD1-CG2 3.59Å; F481-V486 HydrophobicContact CE1-CB 4.49Å; F481-V486 HydrophobicContact CE1-CG2 3.6Å; R482-V486 PolarHBondContact O-N 2.71Å; P483-V486 WeakPolarHBondContact O-CB 3.14Å; P483-V486 PolarHBondContact O-N 3.36Å; V486-S488 PolarHBondContact O-N 2.93Å; V486-R489 PolarHBondContact O-N 3.13Å; V486-M490 HydrophobicContact CG1-SD 3.74Å; V486-M490 WeakPolarHBondContact O-CG 3.3Å; V486-M490 PolarHBondContact O-N 3.47Å
487	A	96.6	Very high	94.4	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.3	-41.6	-179.7	0	0	0	0	0	112	V458 P483 L484 M490 G491 C492 I495 V496 L499	V458-A487 HydrophobicContact CG1-CB 3.91Å; P483-A487 WeakPolarHBondContact O-CB 3.5Å; P483-A487 PolarHBondContact O-N 3.2Å; L484-A487 PolarHBondContact O-N 3.22Å; A487-M490 PolarHBondContact O-N 2.86Å; A487-G491 PolarHBondContact O-N 3.45Å; A487-G491 VanDerWaalsContact O-N 3.1Å; A487-C492 PolarHBondContact O-N 2.98Å; A487-I495 HydrophobicContact CB-CB 4.15Å; A487-I495 HydrophobicContact CB-CG2 3.74Å; A487-V496 HydrophobicContact CB-CG2 3.61Å; A487-L499 HydrophobicContact CB-CD1 4.01Å
488	S	95.1	Very high	94.4	Very high	3 Å²	3	38.6 Å²	38.6	2%	0.021	19%	0.189	C	C	.	.	H	α-helix	trans	-64	-41.7	174.4	-63.2	0	0	0	0	112.5	L484 V486 M490 G491 V520	L484-S488 WeakPolarHBondContact O-CB 3.42Å; L484-S488 PolarHBondContact O-N 3.16Å; L484-S488 PolarHBondContact O-OG 3.28Å; V486-S488 PolarHBondContact O-N 2.93Å; S488-M490 VanDerWaalsContact C-N 3.29Å; S488-M490 PolarHBondContact O-N 3.41Å; S488-G491 PolarHBondContact O-N 3.01Å; S488-G491 VanDerWaalsContact O-N 3.12Å; S488-V520 VanDerWaalsContact OG-CG2 3.25Å; S488-V520 WeakPolarHBondContact OG-CG2 3.31Å
489	R	92.7	Very high	94.6	Very high	134 Å²	134	35.9 Å²	35.9	51%	0.506	18%	0.175	S	C	.	.	H	α-helix	trans	-63.7	-33.1	176.2	-178.4	-179.1	63	155.6	-2.9	112.9	M485 V486 G491 F523	M485-R489 VanDerWaalsContact O-CB 3.3Å; M485-R489 WeakPolarHBondContact O-CB 3.38Å; M485-R489 PolarHBondContact O-N 2.77Å; V486-R489 PolarHBondContact O-N 3.13Å; R489-G491 VanDerWaalsContact C-N 3.34Å; R489-F523 HydrophobicContact CB-CB 4.08Å; R489-F523 HydrophobicContact CB-CD1 3.81Å; R489-F523 HydrophobicContact CB-CG 3.95Å; R489-F523 HydrophobicContact CG-CD1 3.97Å; R489-F523 HydrophobicContact CG-CE1 4.45Å
490	M	92.2	Very high	94.7	Very high	73 Å²	73	36.6 Å²	36.6	36%	0.36	18%	0.179	S	C	.	.	H	α-helix	trans	-82	-10.9	176.1	-66.4	168.7	63.5	0	0	113.3	I459 N461 V486 A487 S488 C492	I459-M490 HydrophobicContact CG1-SD 4.39Å; I459-M490 VanDerWaalsContact O-CE 3.32Å; I459-M490 WeakPolarHBondContact O-CE 3.31Å; N461-M490 HydrophobicContact CB-CE 3.86Å; V486-M490 HydrophobicContact CG1-SD 3.74Å; V486-M490 WeakPolarHBondContact O-CG 3.3Å; V486-M490 PolarHBondContact O-N 3.47Å; A487-M490 PolarHBondContact O-N 2.86Å; S488-M490 VanDerWaalsContact C-N 3.29Å; S488-M490 PolarHBondContact O-N 3.41Å; M490-C492 VanDerWaalsContact C-N 3.3Å; M490-C492 VanDerWaalsContact CB-SG 3.52Å
491	G	89.9	Confident	95.1	Very high	41 Å²	41	38.5 Å²	38.5	42%	0.423	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.6	16.1	-175.2	0	0	0	0	0	114.1	A487 S488 R489 I493	A487-G491 PolarHBondContact O-N 3.45Å; A487-G491 VanDerWaalsContact O-N 3.1Å; S488-G491 PolarHBondContact O-N 3.01Å; S488-G491 VanDerWaalsContact O-N 3.12Å; R489-G491 VanDerWaalsContact C-N 3.34Å; G491-I493 VanDerWaalsContact C-N 3.33Å; G491-I493 PolarHBondContact O-N 3.23Å
492	C	92.2	Very high	95.4	Very high	19 Å²	19	40.7 Å²	40.7	13%	0.128	20%	0.198	C	C	.	.			trans	-81.5	74	-172.2	-62.1	0	0	0	0	111.9	N461 A487 M490 Q494 I495 V496	N461-C492 PolarHBondContact OD1-SG 3Å; A487-C492 PolarHBondContact O-N 2.98Å; M490-C492 VanDerWaalsContact C-N 3.3Å; M490-C492 VanDerWaalsContact CB-SG 3.52Å; C492-Q494 VanDerWaalsContact C-N 3.26Å; C492-Q494 PolarHBondContact O-N 2.97Å; C492-Q494 VanDerWaalsContact O-N 3.16Å; C492-I495 HydrophobicContact CB-CB 4.2Å; C492-I495 HydrophobicContact CB-CD1 4.22Å; C492-I495 HydrophobicContact CB-CG1 4.32Å; C492-I495 PolarHBondContact O-N 3.1Å; C492-V496 PolarHBondContact O-N 2.94Å
493	I	91.8	Very high	95.5	Very high	56 Å²	56	40.4 Å²	40.4	29%	0.287	21%	0.212	S	C	.	.	H	α-helix	trans	-50.7	-43.5	-174.1	-51.7	166.6	0	0	0	112.3	G491 I495 V496 K497 Y527	G491-I493 VanDerWaalsContact C-N 3.33Å; G491-I493 PolarHBondContact O-N 3.23Å; I493-I495 VanDerWaalsContact C-N 3.32Å; I493-I495 PolarHBondContact O-N 3.12Å; I493-V496 PolarHBondContact O-N 3.35Å; I493-K497 HydrophobicContact CG2-CD 4.34Å; I493-K497 HydrophobicContact CG2-CG 4.25Å; I493-K497 WeakPolarHBondContact O-CG 3.35Å; I493-K497 PolarHBondContact O-N 3.09Å; I493-Y527 HydrophobicContact CD1-CE1 3.43Å; I493-Y527 VanDerWaalsContact CD1-CE1 3.43Å; I493-Y527 VanDerWaalsContact CD1-OH 3.25Å; I493-Y527 WeakPolarHBondContact CD1-OH 3.42Å; I493-Y527 HydrophobicContact CG1-CE1 3.78Å
494	Q	95.6	Very high	95.5	Very high	144 Å²	144	40.8 Å²	40.8	67%	0.673	22%	0.215	S	C	*	.	H	α-helix	trans	-59.9	-42.3	-179.3	-64.9	-178.9	4.2	0	0	111.9	T463 C492 L498	T463-Q494 HydrophobicContact CG2-CB 4.04Å; C492-Q494 VanDerWaalsContact C-N 3.26Å; C492-Q494 PolarHBondContact O-N 2.97Å; C492-Q494 VanDerWaalsContact O-N 3.16Å; Q494-L498 VanDerWaalsContact O-CB 3.32Å; Q494-L498 WeakPolarHBondContact O-CB 3.38Å; Q494-L498 PolarHBondContact O-N 3.14Å; Q494-L498 VanDerWaalsContact O-N 3.11Å
495	I	96.9	Very high	95.5	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-70.7	-40	176.3	-60.9	-178	0	0	0	110.6	V458 N461 T463 A487 C492 I493 K497 L498 L499	V458-I495 HydrophobicContact CB-CG2 4.35Å; V458-I495 HydrophobicContact CG1-CG2 3.99Å; V458-I495 HydrophobicContact CG2-CG2 3.71Å; N461-I495 WeakPolarHBondContact OD1-CD1 3Å; T463-I495 HydrophobicContact CG2-CD1 4.1Å; T463-I495 HydrophobicContact CG2-CG1 3.45Å; T463-I495 VanDerWaalsContact CG2-CG1 3.45Å; A487-I495 HydrophobicContact CB-CB 4.15Å; A487-I495 HydrophobicContact CB-CG2 3.74Å; C492-I495 HydrophobicContact CB-CB 4.2Å; C492-I495 HydrophobicContact CB-CD1 4.22Å; C492-I495 HydrophobicContact CB-CG1 4.32Å; C492-I495 PolarHBondContact O-N 3.1Å; I493-I495 VanDerWaalsContact C-N 3.32Å; I493-I495 PolarHBondContact O-N 3.12Å; I495-K497 PolarHBondContact O-N 3.44Å; I495-L498 PolarHBondContact O-N 3.48Å; I495-L499 HydrophobicContact CG2-CD1 3.72Å; I495-L499 HydrophobicContact CG2-CG 4.14Å; I495-L499 WeakPolarHBondContact O-CB 3.37Å; I495-L499 VanDerWaalsContact O-CG 3.23Å; I495-L499 WeakPolarHBondContact O-CG 3.36Å; I495-L499 PolarHBondContact O-N 3.29Å
496	V	97.3	Very high	95.6	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-61.2	-45.2	176.1	174.4	0	0	0	0	111.5	L484 A487 C492 I493 L499 V500 L530 L534	L484-V496 HydrophobicContact CD1-CB 4.38Å; L484-V496 HydrophobicContact CD1-CG1 3.67Å; L484-V496 HydrophobicContact CD1-CG2 4.47Å; A487-V496 HydrophobicContact CB-CG2 3.61Å; C492-V496 PolarHBondContact O-N 2.94Å; I493-V496 PolarHBondContact O-N 3.35Å; V496-L499 PolarHBondContact O-N 3.01Å; V496-V500 HydrophobicContact CG1-CG2 4.35Å; V496-V500 WeakPolarHBondContact O-CB 3.42Å; V496-V500 WeakPolarHBondContact O-CG2 3.12Å; V496-V500 PolarHBondContact O-N 3.4Å; V496-L530 HydrophobicContact CB-CD1 3.91Å; V496-L530 HydrophobicContact CG1-CD1 3.6Å; V496-L530 HydrophobicContact CG2-CD1 4.13Å; V496-L534 HydrophobicContact CG1-CD2 3.96Å
497	K	96.9	Very high	95.5	Very high	88 Å²	88	45.8 Å²	45.8	38%	0.383	24%	0.241	S	C	.	.	H	α-helix	trans	-56.7	-54.4	175.7	-72.1	-171.3	168.6	-164.7	0	111.1	I493 I495 L499 V500 E501 Y533	I493-K497 HydrophobicContact CG2-CD 4.34Å; I493-K497 HydrophobicContact CG2-CG 4.25Å; I493-K497 WeakPolarHBondContact O-CG 3.35Å; I493-K497 PolarHBondContact O-N 3.09Å; I495-K497 PolarHBondContact O-N 3.44Å; K497-L499 VanDerWaalsContact C-N 3.33Å; K497-L499 PolarHBondContact O-N 2.8Å; K497-V500 PolarHBondContact O-N 2.68Å; K497-V500 VanDerWaalsContact O-N 3.14Å; K497-E501 WeakPolarHBondContact O-CB 3.14Å; K497-E501 VanDerWaalsContact O-CG 3.27Å; K497-E501 WeakPolarHBondContact O-CG 3.33Å; K497-E501 PolarHBondContact O-N 3.2Å; K497-Y533 HydrophobicContact CD-CE2 4.27Å; K497-Y533 HydrophobicContact CG-CE1 3.99Å; K497-Y533 HydrophobicContact CG-CE2 3.87Å
498	L	97.8	Very high	95.3	Very high	12 Å²	12	46 Å²	46	6%	0.063	24%	0.243	C	C	.	.	H	α-helix	trans	-56.3	-43.6	179.6	-176.4	71.7	0	0	0	112.5	A466 R467 L470 Q494 I495 H502	A466-L498 HydrophobicContact CB-CD2 4.24Å; R467-L498 HydrophobicContact CB-CD2 4.11Å; R467-L498 HydrophobicContact CG-CD1 4.36Å; L470-L498 HydrophobicContact CD1-CD2 3.87Å; L470-L498 HydrophobicContact CD1-CG 3.67Å; Q494-L498 VanDerWaalsContact O-CB 3.32Å; Q494-L498 WeakPolarHBondContact O-CB 3.38Å; Q494-L498 PolarHBondContact O-N 3.14Å; Q494-L498 VanDerWaalsContact O-N 3.11Å; I495-L498 PolarHBondContact O-N 3.48Å; L498-H502 PolarHBondContact O-N 3.2Å; L498-H502 PolarHBondContact O-ND1 3.21Å
499	L	98.2	Very high	95	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-64.7	-44.1	176.7	-74.3	169	0	0	0	112.1	L454 V458 L470 P476 P483 L484 A487 I495 V496 K497 H502 G503 A504	L454-L499 HydrophobicContact CD1-CD2 4.46Å; L454-L499 HydrophobicContact CD2-CD2 4.16Å; V458-L499 HydrophobicContact CG2-CD1 4.3Å; L470-L499 HydrophobicContact CD1-CD2 3.98Å; L470-L499 HydrophobicContact CD1-CG 4.49Å; L470-L499 HydrophobicContact CD2-CD2 4.29Å; P476-L499 HydrophobicContact CB-CD2 3.69Å; P483-L499 HydrophobicContact CB-CD1 4.11Å; P483-L499 HydrophobicContact CB-CD2 4.16Å; L484-L499 HydrophobicContact CB-CD1 4.43Å; L484-L499 HydrophobicContact CD1-CB 4.35Å; A487-L499 HydrophobicContact CB-CD1 4.01Å; I495-L499 HydrophobicContact CG2-CD1 3.72Å; I495-L499 HydrophobicContact CG2-CG 4.14Å; I495-L499 WeakPolarHBondContact O-CB 3.37Å; I495-L499 VanDerWaalsContact O-CG 3.23Å; I495-L499 WeakPolarHBondContact O-CG 3.36Å; I495-L499 PolarHBondContact O-N 3.29Å; V496-L499 PolarHBondContact O-N 3.01Å; K497-L499 VanDerWaalsContact C-N 3.33Å; K497-L499 PolarHBondContact O-N 2.8Å; L499-H502 CarbonylContact O-C 3.51Å; L499-H502 PolarHBondContact O-N 3.12Å; L499-G503 PolarHBondContact O-N 3.05Å; L499-A504 HydrophobicContact CB-CB 3.88Å; L499-A504 WeakPolarHBondContact O-CB 3.43Å; L499-A504 PolarHBondContact O-N 3.25Å
500	V	97.4	Very high	94.7	Very high	18 Å²	18	42.6 Å²	42.6	11%	0.109	24%	0.243	C	C	.	.	H	α-helix	trans	-65.7	-42.2	178.3	168.8	0	0	0	0	111.3	L484 V496 K497 H502 G503 I506 Y533 L534 H537	L484-V500 HydrophobicContact CD1-CG2 3.92Å; V496-V500 HydrophobicContact CG1-CG2 4.35Å; V496-V500 WeakPolarHBondContact O-CB 3.42Å; V496-V500 WeakPolarHBondContact O-CG2 3.12Å; V496-V500 PolarHBondContact O-N 3.4Å; K497-V500 PolarHBondContact O-N 2.68Å; K497-V500 VanDerWaalsContact O-N 3.14Å; V500-H502 PolarHBondContact O-N 3.25Å; V500-G503 PolarHBondContact O-N 3.1Å; V500-I506 HydrophobicContact CG1-CD1 4.16Å; V500-I506 HydrophobicContact CG2-CD1 4.09Å; V500-I506 HydrophobicContact CG2-CG1 4.12Å; V500-Y533 HydrophobicContact CB-CE1 4.24Å; V500-Y533 HydrophobicContact CG1-CE1 4.27Å; V500-Y533 HydrophobicContact CG2-CE1 4.31Å; V500-L534 HydrophobicContact CG2-CD2 4.15Å; V500-H537 HydrophobicContact CG1-CB 3.6Å
501	E	97	Very high	94.2	Very high	128 Å²	128	43.7 Å²	43.7	60%	0.598	26%	0.255	S	S	*	.	H	α-helix	trans	-58.3	-28.6	174.2	-72.4	162	-167.6	0	0	112.5	K497	K497-E501 WeakPolarHBondContact O-CB 3.14Å; K497-E501 VanDerWaalsContact O-CG 3.27Å; K497-E501 WeakPolarHBondContact O-CG 3.33Å; K497-E501 PolarHBondContact O-N 3.2Å
502	H	97.8	Very high	93.7	Very high	78 Å²	78	45.6 Å²	45.6	36%	0.361	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	22.2	177.2	-65	75.6	0	0	0	113.4	L470 L498 L499 V500	L470-H502 HydrophobicContact CB-CB 4.36Å; L470-H502 HydrophobicContact CD2-CB 3.91Å; L470-H502 HydrophobicContact CG-CB 4.49Å; L498-H502 PolarHBondContact O-N 3.2Å; L498-H502 PolarHBondContact O-ND1 3.21Å; L499-H502 CarbonylContact O-C 3.51Å; L499-H502 PolarHBondContact O-N 3.12Å; V500-H502 PolarHBondContact O-N 3.25Å
503	G	96.6	Very high	93.1	Very high	50 Å²	50	50.4 Å²	50.4	52%	0.515	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.7	27.3	169.8	0	0	0	0	0	115.7	N477 L499 V500 D505	N477-G503 PolarHBondContact ND2-O 3.45Å; L499-G503 PolarHBondContact O-N 3.05Å; V500-G503 PolarHBondContact O-N 3.1Å; G503-D505 PolarHBondContact O-N 3.09Å
504	A	97.5	Very high	92.8	Very high	7 Å²	7	50.9 Å²	50.9	6%	0.058	29%	0.286	C	S	.	.			trans	-65.6	126.1	169.4	0	0	0	0	0	111.7	P476 L484 L499 I506	P476-A504 HydrophobicContact CB-CB 3.82Å; P476-A504 HydrophobicContact CG-CB 3.8Å; L484-A504 HydrophobicContact CB-CB 4.11Å; L484-A504 HydrophobicContact CD2-CB 4.01Å; L484-A504 HydrophobicContact CG-CB 4.44Å; L499-A504 HydrophobicContact CB-CB 3.88Å; L499-A504 WeakPolarHBondContact O-CB 3.43Å; L499-A504 PolarHBondContact O-N 3.25Å; A504-I506 PolarHBondContact O-N 2.76Å; A504-I506 VanDerWaalsContact O-N 3.08Å
505	D	95.9	Very high	92.5	Very high	58 Å²	58	44.9 Å²	44.9	31%	0.31	26%	0.259	S	S	.	.			trans	-69.5	103.3	179.8	179.7	7	0	0	0	111.6	N477 R482 G503 N507 A508	N477-D505 WeakPolarHBondContact OD1-CB 3.36Å; N477-D505 PolarHBondContact OD1-N 2.8Å; R482-D505 IonicContact CZ-OD2 2.72Å; R482-D505 IonicContact NH1-OD2 3.19Å; R482-D505 PolarHBondContact NH1-OD2 3.25Å; R482-D505 IonicContact NH2-OD2 2.8Å; G503-D505 PolarHBondContact O-N 3.09Å; D505-N507 PolarHBondContact O-N 2.79Å; D505-N507 WeakPolarHBondContact OD1-CA 3.25Å; D505-N507 PolarHBondContact OD1-N 3.48Å; D505-A508 HydrophobicContact CB-CB 4.32Å; D505-A508 PolarHBondContact OD1-N 3.33Å; D505-A508 VanDerWaalsContact OD1-N 3.16Å
506	I	96.4	Very high	92.1	Very high	6 Å²	6	47.6 Å²	47.6	3%	0.031	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-32.1	174.4	-58	-179.9	0	0	0	110.9	L484 V500 A504 P518 V520 Y521 L534 H537	L484-I506 HydrophobicContact CD2-CB 4.47Å; L484-I506 HydrophobicContact CD2-CG1 4.07Å; V500-I506 HydrophobicContact CG1-CD1 4.16Å; V500-I506 HydrophobicContact CG2-CD1 4.09Å; V500-I506 HydrophobicContact CG2-CG1 4.12Å; A504-I506 PolarHBondContact O-N 2.76Å; A504-I506 VanDerWaalsContact O-N 3.08Å; I506-P518 WeakPolarHBondContact O-CB 3.31Å; I506-V520 HydrophobicContact CG2-CG1 3.94Å; I506-V520 WeakPolarHBondContact O-CG1 3.5Å; I506-Y521 HydrophobicContact CG2-CE1 4.22Å; I506-L534 HydrophobicContact CD1-CD2 4.11Å; I506-L534 WeakPolarHBondContact CD1-O 3.3Å; I506-L534 HydrophobicContact CG1-CD2 4.13Å; I506-L534 HydrophobicContact CG2-CB 4.12Å; I506-L534 HydrophobicContact CG2-CD2 4.18Å; I506-H537 HydrophobicContact CD1-CB 3.99Å; I506-H537 WeakPolarHBondContact CD1-O 3.39Å
507	N	94.1	Very high	91.8	Very high	46 Å²	46	47.9 Å²	47.9	25%	0.246	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	1.3	-168.8	-62.9	-55.6	0	0	0	113.7	D505 P518 G538 H540	D505-N507 PolarHBondContact O-N 2.79Å; D505-N507 WeakPolarHBondContact OD1-CA 3.25Å; D505-N507 PolarHBondContact OD1-N 3.48Å; N507-P518 HydrophobicContact CB-CG 4.44Å; N507-P518 VanDerWaalsContact OD1-CG 3.31Å; N507-P518 WeakPolarHBondContact OD1-CG 3.17Å; N507-G538 PolarHBondContact ND2-O 2.94Å; N507-H540 PolarHBondContact ND2-CE1 3.27Å; N507-H540 WeakPolarHBondContact OD1-CB 3.46Å; N507-H540 VanDerWaalsContact OD1-CG 3.3Å; N507-H540 PolarHBondContact OD1-N 3.4Å
508	A	92.2	Very high	91.7	Very high	4 Å²	4	44 Å²	44	3%	0.033	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-55	137.1	178.2	0	0	0	0	0	113.3	M485 D505 A519	M485-A508 HydrophobicContact CE-CB 3.64Å; M485-A508 WeakPolarHBondContact CE-O 3.31Å; D505-A508 HydrophobicContact CB-CB 4.32Å; D505-A508 PolarHBondContact OD1-N 3.33Å; D505-A508 VanDerWaalsContact OD1-N 3.16Å; A508-A519 VanDerWaalsContact O-CB 3.31Å; A508-A519 WeakPolarHBondContact O-CB 3.49Å; A508-A519 PolarHBondContact O-N 3.44Å; A508-A519 VanDerWaalsContact O-N 3.07Å
509	A	89.1	Confident	91.5	Very high	58 Å²	58	43.4 Å²	43.4	48%	0.479	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-89.6	157.4	166.3	0	0	0	0	0	111
510	I	86	Confident	91.3	Very high	8 Å²	8	43.4 Å²	43.4	4%	0.041	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-91.9	118.9	170.6	-63.5	161.5	0	0	0	108.3	F481 M485 T512 H513 A519 M522 F523	F481-I510 HydrophobicContact CD2-CD1 4.16Å; F481-I510 HydrophobicContact CD2-CG1 4.17Å; F481-I510 HydrophobicContact CE2-CD1 3.71Å; F481-I510 HydrophobicContact CE2-CG1 4.19Å; M485-I510 HydrophobicContact CE-CG1 4.11Å; M485-I510 HydrophobicContact SD-CD1 3.97Å; M485-I510 HydrophobicContact SD-CG1 3.53Å; M485-I510 VanDerWaalsContact SD-CG1 3.53Å; I510-T512 VanDerWaalsContact C-N 3.27Å; I510-T512 WeakPolarHBondContact CG2-OG1 3.42Å; I510-T512 PolarHBondContact O-N 3.32Å; I510-H513 HydrophobicContact CB-CB 4.36Å; I510-H513 HydrophobicContact CG2-CB 4.09Å; I510-H513 CarbonylContact O-C 3.57Å; I510-H513 PolarHBondContact O-N 3.41Å; I510-A519 HydrophobicContact CD1-CB 3.84Å; I510-A519 HydrophobicContact CG1-CB 3.73Å; I510-M522 HydrophobicContact CD1-CE 3.65Å; I510-F523 HydrophobicContact CD1-CE2 4.28Å; I510-F523 HydrophobicContact CD1-CZ 4.34Å
511	P	81.1	Confident	91.1	Very high	96 Å²	96	42.6 Å²	42.6	62%	0.623	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-33.1	-175.9	-28.1	36.7	0	0	0	114.8	M480	M480-P511 HydrophobicContact CG-CG 4.09Å
512	T	79.3	Confident	90.8	Very high	82 Å²	82	38.5 Å²	38.5	50%	0.503	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-18.6	178.6	53.7	0	0	0	0	113.9	M480 I510	M480-T512 HydrophobicContact CE-CG2 4.41Å; M480-T512 HydrophobicContact SD-CG2 4.36Å; I510-T512 VanDerWaalsContact C-N 3.27Å; I510-T512 WeakPolarHBondContact CG2-OG1 3.42Å; I510-T512 PolarHBondContact O-N 3.32Å
513	H	80.3	Confident	90.4	Very high	120 Å²	120	37.6 Å²	37.6	56%	0.556	23%	0.229	S	C	*	.	B	Isolated β-bridge	trans	-140.2	71.5	-176.3	-65.9	-45.3	0	0	0	109.4	I510 T515	I510-H513 HydrophobicContact CB-CB 4.36Å; I510-H513 HydrophobicContact CG2-CB 4.09Å; I510-H513 CarbonylContact O-C 3.57Å; I510-H513 PolarHBondContact O-N 3.41Å; H513-T515 PolarHBondContact O-N 2.61Å
514	P	84.4	Confident	90.1	Very high	66 Å²	66	35.2 Å²	35.2	43%	0.429	21%	0.205	S	C	.	.			trans	-62	134.7	-177.1	24.7	-33.6	0	0	0	111.2	G580 V581	P514-G580 CarbonylContact O-C 3.56Å; P514-G580 WeakPolarHBondContact O-CA 3.42Å; P514-V581 PolarHBondContact O-N 3.06Å
515	T	89.3	Confident	89.6	Confident	18 Å²	18	35 Å²	35	11%	0.11	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-117.7	151.2	174.1	45.4	0	0	0	0	109.6	H513 F517 M522 V581	H513-T515 PolarHBondContact O-N 2.61Å; T515-F517 VanDerWaalsContact CB-O 3.31Å; T515-F517 WeakPolarHBondContact CB-O 3.37Å; T515-F517 HydrophobicContact CG2-CE1 3.98Å; T515-F517 HydrophobicContact CG2-CZ 3.95Å; T515-F517 PolarHBondContact O-N 3.07Å; T515-F517 PolarHBondContact OG1-O 2.77Å; T515-M522 HydrophobicContact CG2-CE 3.77Å; T515-M522 HydrophobicContact CG2-SD 3.62Å; T515-V581 WeakPolarHBondContact CA-O 3.45Å; T515-V581 HydrophobicContact CG2-CB 4.47Å
516	T	89.1	Confident	89	Confident	56 Å²	56	37.7 Å²	37.7	34%	0.344	21%	0.211	S	C	.	.	S	Bend	trans	-77.3	-2.6	173.2	66.6	0	0	0	0	113.4	P543 V581 Q582	T516-P543 WeakPolarHBondContact O-CB 3.35Å; T516-V581 PolarHBondContact N-O 2.8Å; T516-V581 VanDerWaalsContact N-O 3.1Å; T516-Q582 HydrophobicContact CG2-CG 4.05Å
517	F	91.4	Very high	88.7	Confident	7 Å²	7	42.3 Å²	42.3	3%	0.031	23%	0.229	C	C	.	.	S	Bend	trans	-137.7	162.2	-173.8	62.3	-84.4	0	0	0	110.3	T515 A519 Y521 M522 M525 P543 F583 M586	T515-F517 VanDerWaalsContact CB-O 3.31Å; T515-F517 WeakPolarHBondContact CB-O 3.37Å; T515-F517 HydrophobicContact CG2-CE1 3.98Å; T515-F517 HydrophobicContact CG2-CZ 3.95Å; T515-F517 PolarHBondContact O-N 3.07Å; T515-F517 PolarHBondContact OG1-O 2.77Å; F517-A519 PolarHBondContact O-N 2.8Å; F517-Y521 HydrophobicContact CD2-CD2 4.14Å; F517-M522 HydrophobicContact CE2-CG 3.72Å; F517-M522 HydrophobicContact CZ-CG 3.78Å; F517-M522 HydrophobicContact CZ-SD 4.4Å; F517-M525 HydrophobicContact CD2-CE 4.27Å; F517-M525 HydrophobicContact CE2-CE 3.62Å; F517-M525 HydrophobicContact CZ-CE 4.22Å; F517-P543 HydrophobicContact CB-CB 4.43Å; F517-F583 HydrophobicContact CD1-CB 3.63Å; F517-F583 HydrophobicContact CD1-CD2 4.47Å; F517-F583 HydrophobicContact CD2-CD2 4.26Å; F517-F583 HydrophobicContact CE1-CB 4.01Å; F517-F583 HydrophobicContact CE2-CD2 4.44Å; F517-F583 HydrophobicContact CG-CB 4.08Å; F517-F583 HydrophobicContact CG-CD2 4.27Å; F517-M586 HydrophobicContact CE1-CB 4.45Å; F517-M586 HydrophobicContact CZ-CB 4.11Å; F517-M586 HydrophobicContact CZ-CG 4.22Å
518	P	94.4	Very high	88.5	Confident	5 Å²	5	42.3 Å²	42.3	3%	0.032	23%	0.229	C	C	.	.			trans	-48.2	120.7	178.2	-33.5	39.8	0	0	0	113.5	I506 N507 V520 Y521 H540	I506-P518 WeakPolarHBondContact O-CB 3.31Å; N507-P518 HydrophobicContact CB-CG 4.44Å; N507-P518 VanDerWaalsContact OD1-CG 3.31Å; N507-P518 WeakPolarHBondContact OD1-CG 3.17Å; P518-V520 VanDerWaalsContact C-N 3.26Å; P518-V520 HydrophobicContact CB-CG1 4.44Å; P518-V520 PolarHBondContact O-N 2.52Å; P518-Y521 HydrophobicContact CB-CD1 4.2Å; P518-Y521 HydrophobicContact CB-CD2 3.84Å; P518-Y521 HydrophobicContact CB-CE1 4.02Å; P518-Y521 HydrophobicContact CB-CE2 3.67Å; P518-Y521 HydrophobicContact CB-CG 4.09Å; P518-Y521 HydrophobicContact CG-CD2 4.15Å; P518-Y521 HydrophobicContact CG-CE2 3.57Å; P518-Y521 WeakPolarHBondContact O-CB 3.47Å; P518-Y521 PolarHBondContact O-N 3.08Å; P518-Y521 VanDerWaalsContact O-N 3.12Å; P518-H540 HydrophobicContact CG-CB 4.24Å
519	A	93.2	Very high	88.5	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-26.1	-168.6	0	0	0	0	0	113.1	M485 A508 I510 F517 Y521 M522	M485-A519 HydrophobicContact CE-CB 3.94Å; M485-A519 HydrophobicContact SD-CB 4.33Å; A508-A519 VanDerWaalsContact O-CB 3.31Å; A508-A519 WeakPolarHBondContact O-CB 3.49Å; A508-A519 PolarHBondContact O-N 3.44Å; A508-A519 VanDerWaalsContact O-N 3.07Å; I510-A519 HydrophobicContact CD1-CB 3.84Å; I510-A519 HydrophobicContact CG1-CB 3.73Å; F517-A519 PolarHBondContact O-N 2.8Å; A519-Y521 PolarHBondContact O-N 3.14Å; A519-M522 HydrophobicContact CB-CE 3.88Å; A519-M522 WeakPolarHBondContact O-CB 3.46Å; A519-M522 WeakPolarHBondContact O-CE 3.46Å; A519-M522 PolarHBondContact O-N 3.4Å
520	V	94.1	Very high	88.7	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.006	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-30.3	174.3	69.5	0	0	0	0	112.5	L484 M485 S488 I506 P518 M522 F523 S524 L534	L484-V520 HydrophobicContact CD2-CG2 4.42Å; L484-V520 HydrophobicContact CG-CG2 4.06Å; M485-V520 HydrophobicContact CG-CB 4.37Å; S488-V520 VanDerWaalsContact OG-CG2 3.25Å; S488-V520 WeakPolarHBondContact OG-CG2 3.31Å; I506-V520 HydrophobicContact CG2-CG1 3.94Å; I506-V520 WeakPolarHBondContact O-CG1 3.5Å; P518-V520 VanDerWaalsContact C-N 3.26Å; P518-V520 HydrophobicContact CB-CG1 4.44Å; P518-V520 PolarHBondContact O-N 2.52Å; V520-M522 VanDerWaalsContact C-N 3.25Å; V520-M522 PolarHBondContact O-N 3.37Å; V520-F523 WeakPolarHBondContact O-CB 3.35Å; V520-F523 PolarHBondContact O-N 3.46Å; V520-S524 PolarHBondContact O-N 2.85Å; V520-L534 HydrophobicContact CG1-CD1 4.18Å; V520-L534 HydrophobicContact CG2-CD1 3.93Å
521	Y	93.4	Very high	89.1	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-62.8	-31	-179	-62.5	-15.7	0	0	0	113.1	I506 F517 P518 A519 F523 S524 M525 F531 L534 L535 G539 H540	I506-Y521 HydrophobicContact CG2-CE1 4.22Å; F517-Y521 HydrophobicContact CD2-CD2 4.14Å; P518-Y521 HydrophobicContact CB-CD1 4.2Å; P518-Y521 HydrophobicContact CB-CD2 3.84Å; P518-Y521 HydrophobicContact CB-CE1 4.02Å; P518-Y521 HydrophobicContact CB-CE2 3.67Å; P518-Y521 HydrophobicContact CB-CG 4.09Å; P518-Y521 HydrophobicContact CG-CD2 4.15Å; P518-Y521 HydrophobicContact CG-CE2 3.57Å; P518-Y521 WeakPolarHBondContact O-CB 3.47Å; P518-Y521 PolarHBondContact O-N 3.08Å; P518-Y521 VanDerWaalsContact O-N 3.12Å; A519-Y521 PolarHBondContact O-N 3.14Å; Y521-F523 PolarHBondContact O-N 2.96Å; Y521-S524 WeakPolarHBondContact CA-OG 3.25Å; Y521-S524 PolarHBondContact O-N 3.3Å; Y521-M525 WeakPolarHBondContact O-CB 3.44Å; Y521-M525 WeakPolarHBondContact O-CG 3.44Å; Y521-M525 PolarHBondContact O-N 3.31Å; Y521-F531 AromaticContact CD1-CD2 3.94Å; Y521-F531 HydrophobicContact CD1-CD2 3.94Å; Y521-F531 AromaticContact CD1-CE2 3.69Å; Y521-F531 HydrophobicContact CD1-CE2 3.69Å; Y521-F531 AromaticContact CD2-CE2 3.89Å; Y521-F531 HydrophobicContact CD2-CE2 3.89Å; Y521-F531 HydrophobicContact CE1-CD2 4.4Å; Y521-F531 HydrophobicContact CE1-CE2 4.11Å; Y521-F531 HydrophobicContact CE2-CE2 4.27Å; Y521-F531 HydrophobicContact CG-CD2 4.23Å; Y521-F531 AromaticContact CG-CE2 3.6Å; Y521-F531 HydrophobicContact CG-CE2 3.6Å; Y521-L534 HydrophobicContact CE1-CB 4.37Å; Y521-L535 WeakPolarHBondContact OH-CD2 3.48Å; Y521-G539 WeakPolarHBondContact OH-CA 3.5Å; Y521-G539 PolarHBondContact OH-O 3.33Å; Y521-H540 WeakPolarHBondContact CE2-O 3.32Å; Y521-H540 PolarHBondContact OH-N 3.25Å; Y521-H540 VanDerWaalsContact OH-N 3.09Å; Y521-H540 PolarHBondContact OH-O 3.32Å; Y521-H540 VanDerWaalsContact OH-O 3.14Å
522	M	90.3	Very high	89.7	Confident	43 Å²	43	42.3 Å²	42.3	21%	0.212	22%	0.216	C	C	.	.	H	α-helix	trans	-55.8	-26.1	175.3	-63.5	-170.2	-74.3	0	0	112.4	I510 T515 F517 A519 V520 M586	I510-M522 HydrophobicContact CD1-CE 3.65Å; T515-M522 HydrophobicContact CG2-CE 3.77Å; T515-M522 HydrophobicContact CG2-SD 3.62Å; F517-M522 HydrophobicContact CE2-CG 3.72Å; F517-M522 HydrophobicContact CZ-CG 3.78Å; F517-M522 HydrophobicContact CZ-SD 4.4Å; A519-M522 HydrophobicContact CB-CE 3.88Å; A519-M522 WeakPolarHBondContact O-CB 3.46Å; A519-M522 WeakPolarHBondContact O-CE 3.46Å; A519-M522 PolarHBondContact O-N 3.4Å; V520-M522 VanDerWaalsContact C-N 3.25Å; V520-M522 PolarHBondContact O-N 3.37Å; M522-M586 HydrophobicContact CG-CE 4.13Å; M522-M586 HydrophobicContact SD-CE 3.67Å
523	F	90.7	Very high	90.4	Very high	59 Å²	59	39.8 Å²	39.8	26%	0.259	20%	0.197	S	C	.	.	H	α-helix	trans	-97.7	-28.4	-178.7	-51.8	-60.8	0	0	0	113	F481 M485 R489 I510 V520 Y521	F481-F523 HydrophobicContact CE2-CE2 4.09Å; F481-F523 AromaticContact CE2-CZ 3.98Å; F481-F523 HydrophobicContact CE2-CZ 3.98Å; F481-F523 AromaticContact CZ-CE2 3.89Å; F481-F523 HydrophobicContact CZ-CE2 3.89Å; F481-F523 AromaticContact CZ-CZ 3.79Å; F481-F523 HydrophobicContact CZ-CZ 3.79Å; M485-F523 HydrophobicContact CB-CD2 4.07Å; M485-F523 HydrophobicContact CB-CE2 3.93Å; M485-F523 HydrophobicContact CG-CE2 4.43Å; R489-F523 HydrophobicContact CB-CB 4.08Å; R489-F523 HydrophobicContact CB-CD1 3.81Å; R489-F523 HydrophobicContact CB-CG 3.95Å; R489-F523 HydrophobicContact CG-CD1 3.97Å; R489-F523 HydrophobicContact CG-CE1 4.45Å; I510-F523 HydrophobicContact CD1-CE2 4.28Å; I510-F523 HydrophobicContact CD1-CZ 4.34Å; V520-F523 WeakPolarHBondContact O-CB 3.35Å; V520-F523 PolarHBondContact O-N 3.46Å; Y521-F523 PolarHBondContact O-N 2.96Å
524	S	90.6	Very high	91.1	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-93.8	-19.3	-178.2	66.8	0	0	0	0	115.2	V520 Y521 K526 Y527 F531	V520-S524 PolarHBondContact O-N 2.85Å; Y521-S524 WeakPolarHBondContact CA-OG 3.25Å; Y521-S524 PolarHBondContact O-N 3.3Å; S524-K526 PolarHBondContact O-N 3.01Å; S524-Y527 CarbonylContact O-C 3.58Å; S524-Y527 PolarHBondContact O-N 2.82Å; S524-F531 WeakPolarHBondContact OG-CD2 3.2Å
525	M	86	Confident	91.6	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.005	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51	-34.2	-173.3	-90.6	176	-140.8	0	0	115.1	F517 Y521 Y527 F583 M586 I599	F517-M525 HydrophobicContact CD2-CE 4.27Å; F517-M525 HydrophobicContact CE2-CE 3.62Å; F517-M525 HydrophobicContact CZ-CE 4.22Å; Y521-M525 WeakPolarHBondContact O-CB 3.44Å; Y521-M525 WeakPolarHBondContact O-CG 3.44Å; Y521-M525 PolarHBondContact O-N 3.31Å; M525-Y527 VanDerWaalsContact C-N 3.29Å; M525-Y527 PolarHBondContact O-N 2.98Å; M525-F583 HydrophobicContact CE-CD2 3.76Å; M525-F583 HydrophobicContact CE-CE2 3.54Å; M525-F583 HydrophobicContact SD-CE2 4.09Å; M525-M586 HydrophobicContact CE-CG 4.49Å; M525-M586 HydrophobicContact SD-CG 4.5Å; M525-I599 HydrophobicContact CB-CD1 3.82Å; M525-I599 HydrophobicContact CB-CG1 4.46Å; M525-I599 HydrophobicContact CG-CD1 4.1Å; M525-I599 HydrophobicContact CG-CG2 4.03Å; M525-I599 WeakPolarHBondContact O-CD1 3.38Å; M525-I599 WeakPolarHBondContact O-CG1 3.4Å
526	K	84.3	Confident	91.9	Very high	115 Å²	115	34.5 Å²	34.5	50%	0.5	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-13.1	178.9	-66.9	-174	176.7	-172.8	0	114.1	S524 S591	S524-K526 PolarHBondContact O-N 3.01Å; K526-S591 WeakPolarHBondContact CE-O 3.49Å; K526-S591 PolarHBondContact NZ-O 3.13Å
527	Y	90.2	Very high	92.2	Very high	103 Å²	103	36.2 Å²	36.2	40%	0.404	17%	0.172	S	C	.	.	S	Bend	trans	-124.6	81.5	-178.1	-175.7	-121.7	0	0	0	109.6	I493 S524 M525 P529 L530 F531	I493-Y527 HydrophobicContact CD1-CE1 3.43Å; I493-Y527 VanDerWaalsContact CD1-CE1 3.43Å; I493-Y527 VanDerWaalsContact CD1-OH 3.25Å; I493-Y527 WeakPolarHBondContact CD1-OH 3.42Å; I493-Y527 HydrophobicContact CG1-CE1 3.78Å; S524-Y527 CarbonylContact O-C 3.58Å; S524-Y527 PolarHBondContact O-N 2.82Å; M525-Y527 VanDerWaalsContact C-N 3.29Å; M525-Y527 PolarHBondContact O-N 2.98Å; Y527-P529 VanDerWaalsContact C-N 3.31Å; Y527-P529 HydrophobicContact CD2-CG 4.37Å; Y527-P529 HydrophobicContact CE1-CB 4.16Å; Y527-P529 HydrophobicContact CE2-CB 4.29Å; Y527-P529 HydrophobicContact CE2-CG 3.78Å; Y527-P529 VanDerWaalsContact O-N 3.14Å; Y527-L530 HydrophobicContact CD1-CB 3.32Å; Y527-L530 HydrophobicContact CD1-CD2 4.27Å; Y527-L530 HydrophobicContact CD1-CG 4.42Å; Y527-L530 HydrophobicContact CE1-CB 3.71Å; Y527-L530 HydrophobicContact CG-CB 4.35Å; Y527-L530 PolarHBondContact O-N 3.42Å; Y527-F531 PolarHBondContact O-N 2.97Å; Y527-F531 VanDerWaalsContact O-N 3.13Å
528	L	90	Very high	92.3	Very high	46 Å²	46	37.9 Å²	37.9	24%	0.241	19%	0.192	C	C	.	.	H	α-helix	trans	-49.6	-37.2	-173.2	-60.3	174.7	0	0	0	115	L530 F531 K532 P598 I599	L528-L530 VanDerWaalsContact C-N 3.34Å; L528-L530 PolarHBondContact O-N 3.33Å; L528-F531 HydrophobicContact CD2-CD1 4.45Å; L528-F531 PolarHBondContact O-N 2.87Å; L528-K532 VanDerWaalsContact O-CB 3.29Å; L528-K532 WeakPolarHBondContact O-CB 3.44Å; L528-K532 PolarHBondContact O-N 3.05Å; L528-P598 HydrophobicContact CD1-CB 3.67Å; L528-P598 HydrophobicContact CD2-CB 4.47Å; L528-I599 HydrophobicContact CD2-CG1 3.85Å
529	P	92	Very high	92.3	Very high	78 Å²	78	38.1 Å²	38.1	51%	0.506	20%	0.195	S	C	.	.	H	α-helix	trans	-61.6	-38	176	-24.8	35.7	0	0	0	113.8	Y527 Y533	Y527-P529 VanDerWaalsContact C-N 3.31Å; Y527-P529 HydrophobicContact CD2-CG 4.37Å; Y527-P529 HydrophobicContact CE1-CB 4.16Å; Y527-P529 HydrophobicContact CE2-CB 4.29Å; Y527-P529 HydrophobicContact CE2-CG 3.78Å; Y527-P529 VanDerWaalsContact O-N 3.14Å; P529-Y533 WeakPolarHBondContact O-CB 3.39Å; P529-Y533 PolarHBondContact O-N 3.12Å
530	L	92.6	Very high	92.3	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-73.9	-39.9	175.3	178.2	65.8	0	0	0	111.6	V496 Y527 L528 Y533 L534	V496-L530 HydrophobicContact CB-CD1 3.91Å; V496-L530 HydrophobicContact CG1-CD1 3.6Å; V496-L530 HydrophobicContact CG2-CD1 4.13Å; Y527-L530 HydrophobicContact CD1-CB 3.32Å; Y527-L530 HydrophobicContact CD1-CD2 4.27Å; Y527-L530 HydrophobicContact CD1-CG 4.42Å; Y527-L530 HydrophobicContact CE1-CB 3.71Å; Y527-L530 HydrophobicContact CG-CB 4.35Å; Y527-L530 PolarHBondContact O-N 3.42Å; L528-L530 VanDerWaalsContact C-N 3.34Å; L528-L530 PolarHBondContact O-N 3.33Å; L530-Y533 WeakPolarHBondContact O-CB 3.4Å; L530-Y533 PolarHBondContact O-N 3.09Å; L530-L534 HydrophobicContact CG-CD1 4.41Å; L530-L534 WeakPolarHBondContact O-CG 3.35Å; L530-L534 PolarHBondContact O-N 3.46Å
531	F	93.6	Very high	92.2	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-62.4	-44.6	176.4	-177.8	-127.7	0	0	0	111.6	Y521 S524 Y527 L528 L534 L535 I599 V602 L603	Y521-F531 AromaticContact CD1-CD2 3.94Å; Y521-F531 HydrophobicContact CD1-CD2 3.94Å; Y521-F531 AromaticContact CD1-CE2 3.69Å; Y521-F531 HydrophobicContact CD1-CE2 3.69Å; Y521-F531 AromaticContact CD2-CE2 3.89Å; Y521-F531 HydrophobicContact CD2-CE2 3.89Å; Y521-F531 HydrophobicContact CE1-CD2 4.4Å; Y521-F531 HydrophobicContact CE1-CE2 4.11Å; Y521-F531 HydrophobicContact CE2-CE2 4.27Å; Y521-F531 HydrophobicContact CG-CD2 4.23Å; Y521-F531 AromaticContact CG-CE2 3.6Å; Y521-F531 HydrophobicContact CG-CE2 3.6Å; S524-F531 WeakPolarHBondContact OG-CD2 3.2Å; Y527-F531 PolarHBondContact O-N 2.97Å; Y527-F531 VanDerWaalsContact O-N 3.13Å; L528-F531 HydrophobicContact CD2-CD1 4.45Å; L528-F531 PolarHBondContact O-N 2.87Å; F531-L534 PolarHBondContact O-N 3.49Å; F531-L535 HydrophobicContact CD1-CD1 4.23Å; F531-L535 HydrophobicContact CE1-CD1 4.03Å; F531-L535 HydrophobicContact CE2-CD1 4.32Å; F531-L535 HydrophobicContact CG-CD1 4.48Å; F531-L535 HydrophobicContact CZ-CD1 4.1Å; F531-L535 WeakPolarHBondContact O-CG 3.24Å; F531-L535 PolarHBondContact O-N 3.5Å; F531-L535 VanDerWaalsContact O-N 3.14Å; F531-I599 HydrophobicContact CE1-CG2 3.7Å; F531-I599 HydrophobicContact CZ-CG2 4.04Å; F531-V602 HydrophobicContact CD1-CG1 4.08Å; F531-V602 HydrophobicContact CE1-CB 4.5Å; F531-V602 HydrophobicContact CE1-CG1 4.24Å; F531-L603 HydrophobicContact CE1-CD1 4.41Å; F531-L603 HydrophobicContact CE1-CD2 4.37Å; F531-L603 HydrophobicContact CE1-CG 3.92Å; F531-L603 HydrophobicContact CZ-CD1 3.97Å; F531-L603 HydrophobicContact CZ-CD2 3.74Å; F531-L603 HydrophobicContact CZ-CG 3.67Å
532	K	93.6	Very high	92.1	Very high	87 Å²	87	47.9 Å²	47.9	38%	0.378	24%	0.244	S	C	.	.	H	α-helix	trans	-59.8	-47	172	-168.4	-172.3	169.7	61.6	0	111.4	L528 L534 L535 D536 V602 Y606	L528-K532 VanDerWaalsContact O-CB 3.29Å; L528-K532 WeakPolarHBondContact O-CB 3.44Å; L528-K532 PolarHBondContact O-N 3.05Å; K532-L534 VanDerWaalsContact C-N 3.31Å; K532-L534 PolarHBondContact O-N 3.17Å; K532-L535 WeakPolarHBondContact O-CB 3.45Å; K532-L535 PolarHBondContact O-N 3.43Å; K532-L535 VanDerWaalsContact O-N 3.08Å; K532-D536 VanDerWaalsContact O-CG 3.27Å; K532-D536 PolarHBondContact O-N 3.32Å; K532-V602 HydrophobicContact CB-CG1 4.4Å; K532-Y606 WeakPolarHBondContact CG-OH 3.36Å; K532-Y606 PolarHBondContact NZ-OH 2.98Å
533	Y	95.3	Very high	92.1	Very high	29 Å²	29	47.2 Å²	47.2	11%	0.114	24%	0.242	C	C	.	.	H	α-helix	trans	-55.6	-43.9	176.3	178	-89.6	0	0	0	112.5	K497 V500 P529 L530 L535 D536 H537	K497-Y533 HydrophobicContact CD-CE2 4.27Å; K497-Y533 HydrophobicContact CG-CE1 3.99Å; K497-Y533 HydrophobicContact CG-CE2 3.87Å; V500-Y533 HydrophobicContact CB-CE1 4.24Å; V500-Y533 HydrophobicContact CG1-CE1 4.27Å; V500-Y533 HydrophobicContact CG2-CE1 4.31Å; P529-Y533 WeakPolarHBondContact O-CB 3.39Å; P529-Y533 PolarHBondContact O-N 3.12Å; L530-Y533 WeakPolarHBondContact O-CB 3.4Å; L530-Y533 PolarHBondContact O-N 3.09Å; Y533-L535 VanDerWaalsContact C-N 3.33Å; Y533-L535 PolarHBondContact O-N 3.24Å; Y533-D536 PolarHBondContact O-N 2.81Å; Y533-H537 AromaticContact CD2-CE1 3.53Å; Y533-H537 AromaticContact CD2-ND1 3.78Å; Y533-H537 AromaticContact CE1-ND1 3.98Å; Y533-H537 AromaticContact CE2-CE1 3.12Å; Y533-H537 WeakPolarHBondContact CE2-CE1 3.31Å; Y533-H537 AromaticContact CE2-ND1 3.61Å; Y533-H537 AromaticContact CE2-NE2 3.62Å; Y533-H537 AromaticContact CZ-CE1 3.51Å; Y533-H537 AromaticContact CZ-ND1 3.68Å; Y533-H537 AromaticContact CZ-NE2 3.72Å; Y533-H537 PolarHBondContact O-N 2.94Å; Y533-H537 PolarHBondContact O-ND1 3.04Å
534	L	95.4	Very high	92.1	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-64.9	-36	177.5	-69.4	167.4	0	0	0	112.3	L484 V496 V500 I506 V520 Y521 L530 F531 K532 H537 G539	L484-L534 HydrophobicContact CD1-CD2 4.34Å; V496-L534 HydrophobicContact CG1-CD2 3.96Å; V500-L534 HydrophobicContact CG2-CD2 4.15Å; I506-L534 HydrophobicContact CD1-CD2 4.11Å; I506-L534 WeakPolarHBondContact CD1-O 3.3Å; I506-L534 HydrophobicContact CG1-CD2 4.13Å; I506-L534 HydrophobicContact CG2-CB 4.12Å; I506-L534 HydrophobicContact CG2-CD2 4.18Å; V520-L534 HydrophobicContact CG1-CD1 4.18Å; V520-L534 HydrophobicContact CG2-CD1 3.93Å; Y521-L534 HydrophobicContact CE1-CB 4.37Å; L530-L534 HydrophobicContact CG-CD1 4.41Å; L530-L534 WeakPolarHBondContact O-CG 3.35Å; L530-L534 PolarHBondContact O-N 3.46Å; F531-L534 PolarHBondContact O-N 3.49Å; K532-L534 VanDerWaalsContact C-N 3.31Å; K532-L534 PolarHBondContact O-N 3.17Å; L534-H537 PolarHBondContact O-N 3.24Å; L534-G539 WeakPolarHBondContact O-CA 3.07Å; L534-G539 PolarHBondContact O-N 3.21Å
535	L	95	Very high	92.1	Very high	7 Å²	7	45.1 Å²	45.1	4%	0.037	23%	0.233	C	C	.	.	H	α-helix	trans	-68.8	-44.2	174.7	-68.9	164.5	0	0	0	111.7	Y521 F531 K532 Y533 H537 G538 A541 V602 L603 Y606	Y521-L535 WeakPolarHBondContact OH-CD2 3.48Å; F531-L535 HydrophobicContact CD1-CD1 4.23Å; F531-L535 HydrophobicContact CE1-CD1 4.03Å; F531-L535 HydrophobicContact CE2-CD1 4.32Å; F531-L535 HydrophobicContact CG-CD1 4.48Å; F531-L535 HydrophobicContact CZ-CD1 4.1Å; F531-L535 WeakPolarHBondContact O-CG 3.24Å; F531-L535 PolarHBondContact O-N 3.5Å; F531-L535 VanDerWaalsContact O-N 3.14Å; K532-L535 WeakPolarHBondContact O-CB 3.45Å; K532-L535 PolarHBondContact O-N 3.43Å; K532-L535 VanDerWaalsContact O-N 3.08Å; Y533-L535 VanDerWaalsContact C-N 3.33Å; Y533-L535 PolarHBondContact O-N 3.24Å; L535-H537 PolarHBondContact O-N 3.32Å; L535-H537 VanDerWaalsContact O-N 3.13Å; L535-G538 PolarHBondContact O-N 3.42Å; L535-A541 HydrophobicContact CD2-CB 3.93Å; L535-V602 HydrophobicContact CD1-CG1 3.73Å; L535-L603 HydrophobicContact CD1-CD2 4.21Å; L535-L603 HydrophobicContact CD2-CD2 4.05Å; L535-Y606 HydrophobicContact CB-CD1 3.9Å; L535-Y606 HydrophobicContact CB-CD2 4.01Å; L535-Y606 HydrophobicContact CB-CE1 3.75Å; L535-Y606 HydrophobicContact CB-CE2 3.9Å; L535-Y606 HydrophobicContact CB-CG 4.03Å; L535-Y606 HydrophobicContact CD1-CD2 3.87Å; L535-Y606 HydrophobicContact CD1-CE2 3.92Å; L535-Y606 HydrophobicContact CG-CD2 4.39Å
536	D	95.2	Very high	92.1	Very high	85 Å²	85	50.4 Å²	50.4	46%	0.455	26%	0.258	S	S	.	.	H	α-helix	trans	-58.1	-24.9	176.1	-68	-32.7	0	0	0	112.7	K532 Y533 Y606	K532-D536 VanDerWaalsContact O-CG 3.27Å; K532-D536 PolarHBondContact O-N 3.32Å; Y533-D536 PolarHBondContact O-N 2.81Å; D536-Y606 VanDerWaalsContact OD1-CE1 3.31Å; D536-Y606 WeakPolarHBondContact OD1-CE1 3.43Å; D536-Y606 VanDerWaalsContact OD1-CZ 3.32Å; D536-Y606 PolarHBondContact OD1-OH 3.36Å
537	H	95.4	Very high	92.3	Very high	92 Å²	92	46.2 Å²	46.2	43%	0.426	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	26.4	-177.5	-63.8	71.3	0	0	0	113.6	V500 I506 Y533 L534 L535	V500-H537 HydrophobicContact CG1-CB 3.6Å; I506-H537 HydrophobicContact CD1-CB 3.99Å; I506-H537 WeakPolarHBondContact CD1-O 3.39Å; Y533-H537 AromaticContact CD2-CE1 3.53Å; Y533-H537 AromaticContact CD2-ND1 3.78Å; Y533-H537 AromaticContact CE1-ND1 3.98Å; Y533-H537 AromaticContact CE2-CE1 3.12Å; Y533-H537 WeakPolarHBondContact CE2-CE1 3.31Å; Y533-H537 AromaticContact CE2-ND1 3.61Å; Y533-H537 AromaticContact CE2-NE2 3.62Å; Y533-H537 AromaticContact CZ-CE1 3.51Å; Y533-H537 AromaticContact CZ-ND1 3.68Å; Y533-H537 AromaticContact CZ-NE2 3.72Å; Y533-H537 PolarHBondContact O-N 2.94Å; Y533-H537 PolarHBondContact O-ND1 3.04Å; L534-H537 PolarHBondContact O-N 3.24Å; L535-H537 PolarHBondContact O-N 3.32Å; L535-H537 VanDerWaalsContact O-N 3.13Å
538	G	92.5	Very high	92.1	Very high	43 Å²	43	47.4 Å²	47.4	44%	0.443	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	98.8	11.7	171.1	0	0	0	0	0	115.7	N507 L535 H540	N507-G538 PolarHBondContact ND2-O 2.94Å; L535-G538 PolarHBondContact O-N 3.42Å; G538-H540 PolarHBondContact O-N 3.09Å; G538-H540 PolarHBondContact O-ND1 3.31Å
539	G	94.3	Very high	91.9	Very high	9 Å²	9	48.9 Å²	48.9	9%	0.093	25%	0.249	C	C	.	.			trans	-61.5	129.1	169.5	0	0	0	0	0	112.3	Y521 L534 A541	Y521-G539 WeakPolarHBondContact OH-CA 3.5Å; Y521-G539 PolarHBondContact OH-O 3.33Å; L534-G539 WeakPolarHBondContact O-CA 3.07Å; L534-G539 PolarHBondContact O-N 3.21Å; G539-A541 PolarHBondContact O-N 3.32Å
540	H	93.8	Very high	91.5	Very high	107 Å²	107	46.4 Å²	46.4	50%	0.495	24%	0.238	S	C	.	.			trans	-76.3	113.7	-180	-62.9	-14.7	0	0	0	111.4	N507 P518 Y521 G538 P543	N507-H540 PolarHBondContact ND2-CE1 3.27Å; N507-H540 WeakPolarHBondContact OD1-CB 3.46Å; N507-H540 VanDerWaalsContact OD1-CG 3.3Å; N507-H540 PolarHBondContact OD1-N 3.4Å; P518-H540 HydrophobicContact CG-CB 4.24Å; Y521-H540 WeakPolarHBondContact CE2-O 3.32Å; Y521-H540 PolarHBondContact OH-N 3.25Å; Y521-H540 VanDerWaalsContact OH-N 3.09Å; Y521-H540 PolarHBondContact OH-O 3.32Å; Y521-H540 VanDerWaalsContact OH-O 3.14Å; G538-H540 PolarHBondContact O-N 3.09Å; G538-H540 PolarHBondContact O-ND1 3.31Å; H540-P543 HydrophobicContact CB-CG 4.03Å
541	A	92.3	Very high	90.9	Very high	6 Å²	6	49.2 Å²	49.2	5%	0.05	27%	0.267	C	S	.	.			trans	-84.2	-34.8	176.3	0	0	0	0	0	113.5	L535 G539 P543 C544 L603 V607	L535-A541 HydrophobicContact CD2-CB 3.93Å; G539-A541 PolarHBondContact O-N 3.32Å; A541-P543 VanDerWaalsContact C-CD 3.45Å; A541-C544 VanDerWaalsContact O-CB 3.24Å; A541-C544 WeakPolarHBondContact O-CB 3.42Å; A541-C544 PolarHBondContact O-N 3.22Å; A541-C544 VanDerWaalsContact O-N 3.09Å; A541-L603 HydrophobicContact CB-CD2 3.65Å; A541-V607 HydrophobicContact CB-CG1 3.59Å
542	L	90.8	Very high	90.4	Very high	93 Å²	93	55.5 Å²	55.5	49%	0.487	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-54.2	-42.3	-176	-175.5	62.9	0	0	0	114.6	C544 F545 V607 V610	L542-C544 PolarHBondContact O-N 3.21Å; L542-C544 VanDerWaalsContact O-N 3.12Å; L542-F545 PolarHBondContact O-N 3.05Å; L542-V607 HydrophobicContact CB-CG1 4.27Å; L542-V610 HydrophobicContact CD1-CG1 3.81Å
543	P	90.8	Very high	89.7	Confident	29 Å²	29	56.4 Å²	56.4	19%	0.188	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-63.8	-18.4	180	-21.2	34.2	0	0	0	114.3	T516 F517 H540 A541 F545 H546	T516-P543 WeakPolarHBondContact O-CB 3.35Å; F517-P543 HydrophobicContact CB-CB 4.43Å; H540-P543 HydrophobicContact CB-CG 4.03Å; A541-P543 VanDerWaalsContact C-CD 3.45Å; P543-F545 PolarHBondContact O-N 2.96Å; P543-H546 PolarHBondContact O-N 2.97Å
544	C	90.3	Very high	89.2	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.014	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-66.7	-22.7	172.8	-59.7	0	0	0	0	112.7	A541 L542 F583 L603	A541-C544 VanDerWaalsContact O-CB 3.24Å; A541-C544 WeakPolarHBondContact O-CB 3.42Å; A541-C544 PolarHBondContact O-N 3.22Å; A541-C544 VanDerWaalsContact O-N 3.09Å; L542-C544 PolarHBondContact O-N 3.21Å; L542-C544 VanDerWaalsContact O-N 3.12Å; C544-F583 HydrophobicContact CB-CB 4.13Å; C544-F583 HydrophobicContact CB-CD1 3.84Å; C544-F583 HydrophobicContact CB-CD2 3.69Å; C544-F583 HydrophobicContact CB-CE1 4.14Å; C544-F583 HydrophobicContact CB-CE2 4Å; C544-F583 HydrophobicContact CB-CG 3.6Å; C544-F583 HydrophobicContact CB-CZ 4.21Å; C544-F583 VanDerWaalsContact O-CB 3.3Å; C544-F583 WeakPolarHBondContact O-CB 3.23Å; C544-F583 WeakPolarHBondContact O-CD1 3.2Å; C544-F583 WeakPolarHBondContact O-CG 3.35Å; C544-L603 HydrophobicContact CB-CD1 3.82Å; C544-L603 HydrophobicContact CB-CD2 4.32Å
545	F	89.9	Confident	88.5	Confident	13 Å²	13	58.9 Å²	58.9	6%	0.057	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-97.6	-4.7	178.4	-59	-75.5	0	0	0	113.2	L542 P543 C547 I600 L603 L604 V607 V610 L612 L616	L542-F545 PolarHBondContact O-N 3.05Å; P543-F545 PolarHBondContact O-N 2.96Å; F545-C547 PolarHBondContact O-N 2.98Å; F545-I600 HydrophobicContact CE1-CG2 4.45Å; F545-L603 HydrophobicContact CE2-CB 3.89Å; F545-L603 HydrophobicContact CZ-CB 3.68Å; F545-L604 HydrophobicContact CE1-CD2 4.15Å; F545-L604 HydrophobicContact CZ-CD2 3.88Å; F545-L604 HydrophobicContact CZ-CG 4.1Å; F545-V607 HydrophobicContact CD2-CG1 4.09Å; F545-V607 HydrophobicContact CD2-CG2 4.13Å; F545-V607 HydrophobicContact CE2-CB 4.4Å; F545-V607 HydrophobicContact CE2-CG1 3.92Å; F545-V607 HydrophobicContact CE2-CG2 3.6Å; F545-V607 HydrophobicContact CZ-CG2 4.24Å; F545-V610 HydrophobicContact CB-CB 4.08Å; F545-V610 HydrophobicContact CB-CG1 4.19Å; F545-V610 HydrophobicContact CD1-CB 4.39Å; F545-V610 HydrophobicContact CD1-CG2 3.98Å; F545-V610 HydrophobicContact CD2-CB 4.27Å; F545-V610 HydrophobicContact CD2-CG1 3.99Å; F545-V610 HydrophobicContact CD2-CG2 4.11Å; F545-V610 HydrophobicContact CE1-CG2 4.15Å; F545-V610 HydrophobicContact CE2-CG2 4.27Å; F545-V610 HydrophobicContact CG-CB 3.99Å; F545-V610 HydrophobicContact CG-CG1 4.14Å; F545-V610 HydrophobicContact CG-CG2 3.94Å; F545-V610 HydrophobicContact CZ-CG2 4.28Å; F545-L612 HydrophobicContact CD1-CD2 3.64Å; F545-L612 HydrophobicContact CE1-CD2 3.6Å; F545-L616 HydrophobicContact CD1-CD1 4.37Å
546	H	87.8	Confident	87.7	Confident	113 Å²	113	64.2 Å²	64.2	52%	0.523	36%	0.364	S	S	.	.			trans	-74.8	109.3	173.4	-68.4	178.9	0	0	0	110.3	P543	P543-H546 PolarHBondContact O-N 2.97Å
547	C	87.7	Confident	86.5	Confident	26 Å²	26	63.3 Å²	63.3	18%	0.176	36%	0.359	C	S	.	.			trans	-126.9	127.6	176.4	176.6	0	0	0	0	110.7	F545 Y549 G550 H554 C613	F545-C547 PolarHBondContact O-N 2.98Å; C547-Y549 PolarHBondContact O-N 3.28Å; C547-Y549 PolarHBondContact SG-N 3.49Å; C547-Y549 VanDerWaalsContact SG-N 3.42Å; C547-G550 PolarHBondContact O-N 3.43Å; C547-H554 PolarHBondContact SG-NE2 3.3Å; C547-C613 HydrophobicContact CB-CB 3.61Å
548	R	86.4	Confident	85.1	Confident	129 Å²	129	62.6 Å²	62.6	49%	0.487	36%	0.355	S	S	.	.	S	Bend	trans	-63.4	-22.7	179.7	77.4	-174.2	-62.2	154.5	7.4	114.1	E574 T578	R548-E574 IonicContact NH2-OE2 3.74Å; R548-E574 PolarHBondContact NH2-OE2 2.98Å; R548-T578 PolarHBondContact NH1-O 3.05Å
549	Y	85.1	Confident	83.4	Confident	76 Å²	76	66 Å²	66	30%	0.298	37%	0.367	S	S	.	.	S	Bend	trans	-93.2	-24.7	179.6	-59	-70.5	0	0	0	112.5	C547 G551 Q552 H554 P555	C547-Y549 PolarHBondContact O-N 3.28Å; C547-Y549 PolarHBondContact SG-N 3.49Å; C547-Y549 VanDerWaalsContact SG-N 3.42Å; Y549-G551 PolarHBondContact O-N 3.49Å; Y549-Q552 WeakPolarHBondContact O-CB 3.45Å; Y549-Q552 WeakPolarHBondContact O-CG 3.16Å; Y549-Q552 PolarHBondContact O-N 2.99Å; Y549-H554 AromaticContact CD2-CD2 3.8Å; Y549-H554 AromaticContact CD2-CG 4Å; Y549-P555 HydrophobicContact CE2-CG 4.21Å
550	G	84.6	Confident	81.1	Confident	27 Å²	27	68.2 Å²	68.2	28%	0.278	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	-123.6	-175.9	0	0	0	0	0	112.1	C547 Q552 C613 S614	C547-G550 PolarHBondContact O-N 3.43Å; G550-Q552 VanDerWaalsContact C-N 3.27Å; G550-Q552 PolarHBondContact O-N 2.93Å; G550-C613 CarbonylContact O-C 3.49Å; G550-C613 WeakPolarHBondContact O-CA 3.29Å; G550-C613 WeakPolarHBondContact O-CB 3.38Å; G550-S614 PolarHBondContact O-N 2.94Å
551	G	79.6	Confident	78.8	Confident	60 Å²	60	73.6 Å²	73.6	62%	0.619	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-2.6	176	0	0	0	0	0	115.9	Y549	Y549-G551 PolarHBondContact O-N 3.49Å
552	Q	83.3	Confident	76.3	Confident	133 Å²	133	76.6 Å²	76.6	62%	0.621	42%	0.418	S	S	*	.	S	Bend	trans	-79.9	150.9	-177.9	-58.6	-59.9	-30.2	0	0	112.3	Y549 G550 H554 S614	Y549-Q552 WeakPolarHBondContact O-CB 3.45Å; Y549-Q552 WeakPolarHBondContact O-CG 3.16Å; Y549-Q552 PolarHBondContact O-N 2.99Å; G550-Q552 VanDerWaalsContact C-N 3.27Å; G550-Q552 PolarHBondContact O-N 2.93Å; Q552-H554 PolarHBondContact O-CE1 3.12Å; Q552-H554 PolarHBondContact O-N 3.22Å; Q552-H554 PolarHBondContact O-ND1 2.97Å; Q552-S614 PolarHBondContact O-OG 3Å
553	P	78.8	Confident	74.1	Confident	106 Å²	106	75.1 Å²	75.1	69%	0.688	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-59.2	131	176.9	24.6	-34.7	0	0	0	111.3
554	H	83.8	Confident	71.8	Confident	24 Å²	24	79.7 Å²	79.7	11%	0.111	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-89.1	147	-177	-65.9	44.7	0	0	0	111.3	C547 Y549 Q552 C613 S614 R615	C547-H554 PolarHBondContact SG-NE2 3.3Å; Y549-H554 AromaticContact CD2-CD2 3.8Å; Y549-H554 AromaticContact CD2-CG 4Å; Q552-H554 PolarHBondContact O-CE1 3.12Å; Q552-H554 PolarHBondContact O-N 3.22Å; Q552-H554 PolarHBondContact O-ND1 2.97Å; H554-C613 PolarHBondContact NE2-SG 3.11Å; H554-S614 PolarHBondContact ND1-OG 3.36Å; H554-R615 VanDerWaalsContact CB-NH2 3.27Å
555	P	82.1	Confident	69.5	Low	57 Å²	57	85.9 Å²	85.9	37%	0.37	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-63.6	154.1	174.5	28.6	-36.1	0	0	0	111.8	Y549 R615	Y549-P555 HydrophobicContact CE2-CG 4.21Å; P555-R615 PolarHBondContact O-NH2 3.29Å
556	P	78.1	Confident	67.2	Low	119 Å²	119	92 Å²	92	77%	0.773	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-56.8	144.9	-178.4	23.6	-34.3	0	0	0	112.3	K558	P556-K558 PolarHBondContact O-N 3.35Å
557	L	70.4	Confident	65	Low	65 Å²	65	88.8 Å²	88.8	34%	0.34	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-63.8	122.8	-177.6	-67.3	165.7	0	0	0	110.9	T559 S588	L557-T559 HydrophobicContact CB-CG2 4.34Å; L557-T559 PolarHBondContact O-N 2.76Å; L557-S588 WeakPolarHBondContact CD1-O 3.17Å
558	K	65.5	Low	63	Low	78 Å²	78	91 Å²	91	34%	0.339	49%	0.492	S	S	.	.			trans	-76.1	87.7	171.7	-67.6	-172.8	175.2	-167.1	0	110.1	P556 N563 W564 D567	P556-K558 PolarHBondContact O-N 3.35Å; K558-N563 HydrophobicContact CD-CB 4.27Å; K558-N563 WeakPolarHBondContact CD-O 3.48Å; K558-N563 HydrophobicContact CG-CB 4.48Å; K558-N563 PolarHBondContact NZ-O 3.05Å; K558-W564 HydrophobicContact CB-CZ2 4.12Å; K558-W564 PolarHBondContact O-NE1 3.22Å; K558-D567 IonicContact NZ-OD2 2.7Å; K558-D567 PolarHBondContact NZ-OD2 2.81Å
559	T	56.3	Low	60.8	Low	115 Å²	115	92.2 Å²	92.2	71%	0.706	51%	0.508	S	S	*	.			trans	-78.7	-21.6	-177.8	53.2	0	0	0	0	114.1	L557	L557-T559 HydrophobicContact CB-CG2 4.34Å; L557-T559 PolarHBondContact O-N 2.76Å
560	S	45.8	Very low	58.6	Low	54 Å²	54	97.1 Å²	97.1	38%	0.378	53%	0.526	S	S	.	.	S	Bend	trans	-93.5	141.8	178.4	-174.7	0	0	0	0	112.8	S562 N563 W564	S560-S562 PolarHBondContact O-N 3.03Å; S560-S562 PolarHBondContact OG-N 3.49Å; S560-S562 PolarHBondContact OG-OG 2.96Å; S560-N563 PolarHBondContact O-N 3.29Å; S560-W564 PolarHBondContact O-NE1 2.95Å
561	R	46.7	Very low	56.3	Low	221 Å²	221	101.7 Å²	101.7	83%	0.834	55%	0.551	S	S	*	*	G	3₁₀ helix	trans	-66.5	-22.4	177.8	-143.2	172.2	-176.4	173.8	-1.6	112.9
562	S	39.7	Very low	54.6	Low	69 Å²	69	103.8 Å²	103.8	48%	0.483	56%	0.563	S	S	.	*	G	3₁₀ helix	trans	-66.6	-40.7	176.2	48.4	0	0	0	0	113.5	S560 W564 N565	S560-S562 PolarHBondContact O-N 3.03Å; S560-S562 PolarHBondContact OG-N 3.49Å; S560-S562 PolarHBondContact OG-OG 2.96Å; S562-W564 PolarHBondContact O-N 2.96Å; S562-N565 PolarHBondContact O-N 3.34Å
563	N	43.6	Very low	52.3	Low	61 Å²	61	102.3 Å²	102.3	33%	0.326	57%	0.573	S	S	.	*	G	3₁₀ helix	trans	-77.5	1.8	-167.8	-60.2	34.1	0	0	0	113.4	K558 S560	K558-N563 HydrophobicContact CD-CB 4.27Å; K558-N563 WeakPolarHBondContact CD-O 3.48Å; K558-N563 HydrophobicContact CG-CB 4.48Å; K558-N563 PolarHBondContact NZ-O 3.05Å; S560-N563 PolarHBondContact O-N 3.29Å
564	W	42.5	Very low	50.4	Low	125 Å²	125	103.5 Å²	103.5	47%	0.473	57%	0.569	S	S	.	*	G	3₁₀ helix	trans	-86.5	-23.8	174.9	-62.5	83.3	0	0	0	112.2	K558 S560 S562 V581	K558-W564 HydrophobicContact CB-CZ2 4.12Å; K558-W564 PolarHBondContact O-NE1 3.22Å; S560-W564 PolarHBondContact O-NE1 2.95Å; S562-W564 PolarHBondContact O-N 2.96Å; W564-V581 HydrophobicContact CH2-CG2 3.95Å; W564-V581 HydrophobicContact CZ3-CG2 3.91Å
565	N	41.3	Very low	48	Very low	133 Å²	133	104.9 Å²	104.9	71%	0.711	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-26.5	178.6	-74	-6.9	0	0	0	113.2	S562 D567 A568	S562-N565 PolarHBondContact O-N 3.34Å; N565-D567 PolarHBondContact O-N 3.48Å; N565-A568 WeakPolarHBondContact O-CB 3.47Å; N565-A568 PolarHBondContact O-N 3.04Å
566	E	42	Very low	45.9	Very low	141 Å²	141	108.2 Å²	108.2	66%	0.659	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-68.5	-14.4	-174.1	-63.8	178.7	138	0	0	114.7	A568	E566-A568 VanDerWaalsContact C-N 3.3Å
567	D	42.9	Very low	44.1	Very low	45 Å²	45	111.1 Å²	111.1	24%	0.241	61%	0.614	C	S	.	*	G	3₁₀ helix	trans	-87.3	8.2	175.4	-84.3	-47.9	0	0	0	113.4	K558 N565 D569 R570 R579	K558-D567 IonicContact NZ-OD2 2.7Å; K558-D567 PolarHBondContact NZ-OD2 2.81Å; N565-D567 PolarHBondContact O-N 3.48Å; D567-D569 PolarHBondContact O-N 2.67Å; D567-R570 IonicContact OD1-CZ 3.87Å; D567-R570 IonicContact OD1-NE 3.97Å; D567-R570 PolarHBondContact OD1-NE 2.81Å; D567-R570 IonicContact OD1-NH2 2.75Å; D567-R579 PolarHBondContact O-NH2 3.32Å
568	A	45.7	Very low	42.9	Very low	72 Å²	72	111.5 Å²	111.5	60%	0.595	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-61.4	-30.8	174.2	0	0	0	0	0	113.2	N565 E566	N565-A568 WeakPolarHBondContact O-CB 3.47Å; N565-A568 PolarHBondContact O-N 3.04Å; E566-A568 VanDerWaalsContact C-N 3.3Å
569	D	38.6	Very low	42.8	Very low	155 Å²	155	116.2 Å²	116.2	83%	0.829	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-98	12.4	-170.1	-70.9	-37.1	0	0	0	115.7	D567	D567-D569 PolarHBondContact O-N 2.67Å
570	R	40.4	Very low	43.6	Very low	180 Å²	180	111.7 Å²	111.7	68%	0.679	61%	0.611	S	S	*	*	S	Bend	trans	-87	134.5	170.8	-66.6	-169	-159	-113.5	-4.1	111.3	D567 A572	D567-R570 IonicContact OD1-CZ 3.87Å; D567-R570 IonicContact OD1-NE 3.97Å; D567-R570 PolarHBondContact OD1-NE 2.81Å; D567-R570 IonicContact OD1-NH2 2.75Å; R570-A572 PolarHBondContact O-N 3.48Å
571	P	34.7	Very low	45.5	Very low	123 Å²	123	110.8 Å²	110.8	80%	0.799	60%	0.603	S	S	*	*			trans	-62.8	133.9	-178.3	25.4	-33.9	0	0	0	111.9	A573	P571-A573 PolarHBondContact O-N 3.22Å
572	A	43.6	Very low	47.5	Very low	104 Å²	104	100.7 Å²	100.7	86%	0.86	57%	0.566	S	S	*	*			trans	-72.6	112.7	-176.5	0	0	0	0	0	111.8	R570	R570-A572 PolarHBondContact O-N 3.48Å
573	A	35.6	Very low	50	Low	101 Å²	101	97.4 Å²	97.4	84%	0.835	54%	0.543	S	S	*	.			trans	-119.3	-1.9	173.7	0	0	0	0	0	113.7	P571	P571-A573 PolarHBondContact O-N 3.22Å
574	E	38.6	Very low	52.2	Low	132 Å²	132	94.7 Å²	94.7	62%	0.617	53%	0.528	S	S	*	.	S	Bend	trans	-132	148.6	176.8	-68.3	-174.1	169.1	0	0	110.7	R548	R548-E574 IonicContact NH2-OE2 3.74Å; R548-E574 PolarHBondContact NH2-OE2 2.98Å
575	G	34.5	Very low	54.4	Low	52 Å²	52	90.6 Å²	90.6	54%	0.536	51%	0.514	S	S	.	.			trans	-71.6	173	-169.4	0	0	0	0	0	116	H577 T578	G575-H577 PolarHBondContact O-N 3.46Å; G575-T578 PolarHBondContact O-OG1 3.27Å
576	P	37.2	Very low	56.6	Low	127 Å²	127	86.3 Å²	86.3	83%	0.825	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-2.3	-161.2	-23.3	34.9	0	0	0	117.7
577	H	40.4	Very low	58.8	Low	181 Å²	181	79.6 Å²	79.6	84%	0.838	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107	-0.2	-166.6	-64	-65.2	0	0	0	115.3	G575	G575-H577 PolarHBondContact O-N 3.46Å
578	T	46	Very low	61	Low	73 Å²	73	77.7 Å²	77.7	45%	0.448	45%	0.45	S	S	.	.	S	Bend	trans	-111.1	26.3	-171.5	52.3	0	0	0	0	114.7	R548 G575	R548-T578 PolarHBondContact NH1-O 3.05Å; G575-T578 PolarHBondContact O-OG1 3.27Å
579	R	62.2	Low	62.9	Low	177 Å²	177	75.4 Å²	75.4	67%	0.668	43%	0.431	S	S	*	.			trans	-116.4	14.4	-176.4	-124.6	179.6	-166.3	-164.6	0.9	115.7	D567	D567-R579 PolarHBondContact O-NH2 3.32Å
580	G	72.8	Confident	65.1	Low	20 Å²	20	72.7 Å²	72.7	21%	0.206	42%	0.421	C	S	.	.	S	Bend	trans	-86.9	159.3	176.6	0	0	0	0	0	114.1	P514 Q582	P514-G580 CarbonylContact O-C 3.56Å; P514-G580 WeakPolarHBondContact O-CA 3.42Å; G580-Q582 PolarHBondContact O-N 3.28Å
581	V	85.8	Confident	67.1	Low	34 Å²	34	67.8 Å²	67.8	21%	0.206	41%	0.414	C	S	.	.	B	Isolated β-bridge	trans	-66.5	128.3	176.8	-178.8	0	0	0	0	109.7	P514 T515 T516 W564 E585 M586	P514-V581 PolarHBondContact O-N 3.06Å; T515-V581 WeakPolarHBondContact CA-O 3.45Å; T515-V581 HydrophobicContact CG2-CB 4.47Å; T516-V581 PolarHBondContact N-O 2.8Å; T516-V581 VanDerWaalsContact N-O 3.1Å; W564-V581 HydrophobicContact CH2-CG2 3.95Å; W564-V581 HydrophobicContact CZ3-CG2 3.91Å; V581-E585 HydrophobicContact CG1-CB 4.38Å; V581-M586 HydrophobicContact CG1-CB 4.45Å; V581-M586 HydrophobicContact CG1-CE 4.26Å
582	Q	90.1	Very high	69.5	Low	10 Å²	10	62.4 Å²	62.4	5%	0.047	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-83	149.1	179.2	-60.1	-178.7	97.8	0	0	111.1	T516 G580 C584 E585 M586	T516-Q582 HydrophobicContact CG2-CG 4.05Å; G580-Q582 PolarHBondContact O-N 3.28Å; Q582-C584 VanDerWaalsContact C-N 3.27Å; Q582-C584 PolarHBondContact O-N 3.46Å; Q582-E585 HydrophobicContact CB-CB 4.5Å; Q582-E585 HydrophobicContact CB-CG 4.16Å; Q582-E585 PolarHBondContact N-OE2 3.31Å; Q582-E585 PolarHBondContact NE2-OE1 2.89Å; Q582-E585 WeakPolarHBondContact O-CB 3.08Å; Q582-E585 PolarHBondContact O-N 2.92Å; Q582-M586 PolarHBondContact O-N 3.32Å
583	F	90.9	Very high	71.5	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-58	-40.7	177.4	175.7	-92.7	0	0	0	112.4	F517 M525 C544 E585 M586 I587 I599 L603 L616	F517-F583 HydrophobicContact CD1-CB 3.63Å; F517-F583 HydrophobicContact CD1-CD2 4.47Å; F517-F583 HydrophobicContact CD2-CD2 4.26Å; F517-F583 HydrophobicContact CE1-CB 4.01Å; F517-F583 HydrophobicContact CE2-CD2 4.44Å; F517-F583 HydrophobicContact CG-CB 4.08Å; F517-F583 HydrophobicContact CG-CD2 4.27Å; M525-F583 HydrophobicContact CE-CD2 3.76Å; M525-F583 HydrophobicContact CE-CE2 3.54Å; M525-F583 HydrophobicContact SD-CE2 4.09Å; C544-F583 HydrophobicContact CB-CB 4.13Å; C544-F583 HydrophobicContact CB-CD1 3.84Å; C544-F583 HydrophobicContact CB-CD2 3.69Å; C544-F583 HydrophobicContact CB-CE1 4.14Å; C544-F583 HydrophobicContact CB-CE2 4Å; C544-F583 HydrophobicContact CB-CG 3.6Å; C544-F583 HydrophobicContact CB-CZ 4.21Å; C544-F583 VanDerWaalsContact O-CB 3.3Å; C544-F583 WeakPolarHBondContact O-CB 3.23Å; C544-F583 WeakPolarHBondContact O-CD1 3.2Å; C544-F583 WeakPolarHBondContact O-CG 3.35Å; F583-E585 PolarHBondContact O-N 3.16Å; F583-M586 PolarHBondContact O-N 3.06Å; F583-I587 HydrophobicContact CE1-CB 4.42Å; F583-I587 HydrophobicContact CE1-CD1 3.85Å; F583-I587 HydrophobicContact CE1-CG2 4.39Å; F583-I587 HydrophobicContact CZ-CD1 3.7Å; F583-I587 PolarHBondContact O-N 3.1Å; F583-I599 HydrophobicContact CE2-CG2 4.35Å; F583-I599 HydrophobicContact CZ-CG2 3.92Å; F583-L603 HydrophobicContact CE1-CD1 3.94Å; F583-L603 HydrophobicContact CE2-CD1 3.71Å; F583-L603 HydrophobicContact CZ-CD1 3.26Å; F583-L616 HydrophobicContact CE1-CD2 4.4Å
584	C	89.9	Confident	73.9	Confident	3 Å²	3	63 Å²	63	2%	0.02	34%	0.341	C	S	.	.	H	α-helix	trans	-64.9	-24.4	175.6	65.6	0	0	0	0	113.3	Q582 S588 C613 R615 L616	Q582-C584 VanDerWaalsContact C-N 3.27Å; Q582-C584 PolarHBondContact O-N 3.46Å; C584-S588 WeakPolarHBondContact O-CB 3.15Å; C584-S588 PolarHBondContact O-OG 3.44Å; C584-C613 VanDerWaalsContact CB-SG 3.56Å; C584-R615 HydrophobicContact CB-CG 4.45Å; C584-R615 WeakPolarHBondContact O-CD 3.18Å; C584-L616 HydrophobicContact CB-CD1 4.39Å; C584-L616 HydrophobicContact CB-CD2 4.01Å; C584-L616 HydrophobicContact CB-CG 3.92Å
585	E	88.7	Confident	76.2	Confident	40 Å²	40	62.6 Å²	62.6	19%	0.187	33%	0.334	C	S	.	.	H	α-helix	trans	-79.3	-41.1	173.2	-68.4	158.6	-179.8	0	0	111.1	V581 Q582 F583 A589	V581-E585 HydrophobicContact CG1-CB 4.38Å; Q582-E585 HydrophobicContact CB-CB 4.5Å; Q582-E585 HydrophobicContact CB-CG 4.16Å; Q582-E585 PolarHBondContact N-OE2 3.31Å; Q582-E585 PolarHBondContact NE2-OE1 2.89Å; Q582-E585 WeakPolarHBondContact O-CB 3.08Å; Q582-E585 PolarHBondContact O-N 2.92Å; F583-E585 PolarHBondContact O-N 3.16Å; E585-A589 PolarHBondContact O-N 3.24Å
586	M	88.1	Confident	78.7	Confident	43 Å²	43	60.1 Å²	60.1	21%	0.212	31%	0.308	C	S	.	.	H	α-helix	trans	-64.2	-49.8	179.2	-178.6	55.3	69.8	0	0	112	F517 M522 M525 V581 Q582 F583 S588 A589 I592	F517-M586 HydrophobicContact CE1-CB 4.45Å; F517-M586 HydrophobicContact CZ-CB 4.11Å; F517-M586 HydrophobicContact CZ-CG 4.22Å; M522-M586 HydrophobicContact CG-CE 4.13Å; M522-M586 HydrophobicContact SD-CE 3.67Å; M525-M586 HydrophobicContact CE-CG 4.49Å; M525-M586 HydrophobicContact SD-CG 4.5Å; V581-M586 HydrophobicContact CG1-CB 4.45Å; V581-M586 HydrophobicContact CG1-CE 4.26Å; Q582-M586 PolarHBondContact O-N 3.32Å; F583-M586 PolarHBondContact O-N 3.06Å; M586-S588 PolarHBondContact O-N 3.23Å; M586-A589 VanDerWaalsContact O-CB 3.24Å; M586-A589 WeakPolarHBondContact O-CB 3.19Å; M586-A589 PolarHBondContact O-N 2.92Å; M586-A589 VanDerWaalsContact O-N 3.12Å; M586-I592 HydrophobicContact CG-CD1 4.14Å; M586-I592 HydrophobicContact SD-CD1 3.81Å
587	I	89	Confident	81.2	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-67.7	-27.6	-176.9	-152.5	178.3	0	0	0	112.4	F583 A589 I592 C593 A596 I599 I600 L616	F583-I587 HydrophobicContact CE1-CB 4.42Å; F583-I587 HydrophobicContact CE1-CD1 3.85Å; F583-I587 HydrophobicContact CE1-CG2 4.39Å; F583-I587 HydrophobicContact CZ-CD1 3.7Å; F583-I587 PolarHBondContact O-N 3.1Å; I587-A589 VanDerWaalsContact C-N 3.28Å; I587-A589 PolarHBondContact O-N 2.89Å; I587-I592 HydrophobicContact CG1-CG2 4.03Å; I587-C593 WeakPolarHBondContact O-CA 3.24Å; I587-C593 PolarHBondContact O-N 2.93Å; I587-A596 HydrophobicContact CD1-CB 3.83Å; I587-A596 HydrophobicContact CG1-CB 3.84Å; I587-I599 HydrophobicContact CD1-CB 4.08Å; I587-I599 HydrophobicContact CD1-CD1 4.47Å; I587-I599 HydrophobicContact CD1-CG2 3.96Å; I587-I599 HydrophobicContact CG1-CD1 4.4Å; I587-I600 HydrophobicContact CD1-CD1 4.07Å; I587-I600 HydrophobicContact CD1-CG1 3.79Å; I587-L616 HydrophobicContact CG2-CD2 3.63Å
588	S	88.3	Confident	83.6	Confident	5 Å²	5	47.3 Å²	47.3	4%	0.035	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-10.5	175.1	-69.6	0	0	0	0	114.5	L557 C584 M586 R615 H619	L557-S588 WeakPolarHBondContact CD1-O 3.17Å; C584-S588 WeakPolarHBondContact O-CB 3.15Å; C584-S588 PolarHBondContact O-OG 3.44Å; M586-S588 PolarHBondContact O-N 3.23Å; S588-R615 VanDerWaalsContact OG-CD 3.27Å; S588-R615 WeakPolarHBondContact OG-CD 3.46Å; S588-R615 WeakPolarHBondContact OG-CG 3.47Å; S588-H619 WeakPolarHBondContact CA-NE2 3.15Å; S588-H619 WeakPolarHBondContact CB-NE2 3.27Å; S588-H619 PolarHBondContact OG-CD2 3.12Å; S588-H619 PolarHBondContact OG-NE2 2.95Å
589	A	86.4	Confident	85.8	Confident	24 Å²	24	43.9 Å²	43.9	20%	0.198	22%	0.22	C	C	.	.	S	Bend	trans	-58.4	140.4	177.7	0	0	0	0	0	110.9	E585 M586 I587 S591 I592 C593	E585-A589 PolarHBondContact O-N 3.24Å; M586-A589 VanDerWaalsContact O-CB 3.24Å; M586-A589 WeakPolarHBondContact O-CB 3.19Å; M586-A589 PolarHBondContact O-N 2.92Å; M586-A589 VanDerWaalsContact O-N 3.12Å; I587-A589 VanDerWaalsContact C-N 3.28Å; I587-A589 PolarHBondContact O-N 2.89Å; A589-S591 PolarHBondContact O-N 3.39Å; A589-I592 PolarHBondContact O-N 3.42Å; A589-C593 PolarHBondContact O-N 3.21Å
590	P	84	Confident	87.2	Confident	97 Å²	97	35.4 Å²	35.4	63%	0.63	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-22.6	-177.8	-28.4	35.3	0	0	0	115
591	S	82.8	Confident	88	Confident	77 Å²	77	37.1 Å²	37.1	54%	0.538	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-8.1	178.9	62.5	0	0	0	0	114.6	K526 A589	K526-S591 WeakPolarHBondContact CE-O 3.49Å; K526-S591 PolarHBondContact NZ-O 3.13Å; A589-S591 PolarHBondContact O-N 3.39Å
592	I	84.1	Confident	88.3	Confident	10 Å²	10	36.5 Å²	36.5	5%	0.051	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.8	-30.9	-176.8	-59.9	177.7	0	0	0	112.1	M586 I587 A589 R594 W595 I599	M586-I592 HydrophobicContact CG-CD1 4.14Å; M586-I592 HydrophobicContact SD-CD1 3.81Å; I587-I592 HydrophobicContact CG1-CG2 4.03Å; A589-I592 PolarHBondContact O-N 3.42Å; I592-R594 PolarHBondContact O-N 3.33Å; I592-W595 WeakPolarHBondContact O-CA 3.33Å; I592-W595 WeakPolarHBondContact O-CB 3.23Å; I592-W595 PolarHBondContact O-N 2.84Å; I592-I599 HydrophobicContact CG2-CD1 4Å
593	C	85.8	Confident	88.4	Confident	25 Å²	25	36 Å²	36	17%	0.169	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-52.8	-29.5	-168.5	64.8	0	0	0	0	116.3	I587 A589 W595 A596	I587-C593 WeakPolarHBondContact O-CA 3.24Å; I587-C593 PolarHBondContact O-N 2.93Å; A589-C593 PolarHBondContact O-N 3.21Å; C593-W595 PolarHBondContact O-N 2.69Å; C593-A596 WeakPolarHBondContact O-CB 3.5Å; C593-A596 PolarHBondContact O-N 3.06Å; C593-A596 VanDerWaalsContact O-N 3.13Å
594	R	86.1	Confident	88.4	Confident	192 Å²	192	36.7 Å²	36.7	73%	0.725	19%	0.19	S	C	*	.	G	3₁₀ helix	trans	-65.3	-20.2	173.9	-67.2	-178.9	178.8	163.4	0.1	114.3	I592 W626	I592-R594 PolarHBondContact O-N 3.33Å; R594-W626 WeakPolarHBondContact O-CZ2 3.19Å
595	W	86.6	Confident	88.4	Confident	124 Å²	124	40.5 Å²	40.5	47%	0.47	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-99.6	1.3	176.8	-58.3	94.6	0	0	0	112.4	I592 C593 G597 P598 I599	I592-W595 WeakPolarHBondContact O-CA 3.33Å; I592-W595 WeakPolarHBondContact O-CB 3.23Å; I592-W595 PolarHBondContact O-N 2.84Å; C593-W595 PolarHBondContact O-N 2.69Å; W595-G597 PolarHBondContact O-N 3.48Å; W595-P598 WeakPolarHBondContact O-CD 3.29Å; W595-I599 HydrophobicContact CB-CD1 3.72Å; W595-I599 HydrophobicContact CB-CG1 4.33Å; W595-I599 WeakPolarHBondContact O-CD1 3.36Å; W595-I599 VanDerWaalsContact O-CG1 3.23Å; W595-I599 WeakPolarHBondContact O-CG1 3.39Å; W595-I599 PolarHBondContact O-N 3.48Å; W595-I599 VanDerWaalsContact O-N 3.11Å
596	A	88.3	Confident	88.4	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-58.2	-49.7	-171	0	0	0	0	0	112.9	I587 C593 I599 I600 H619 W626	I587-A596 HydrophobicContact CD1-CB 3.83Å; I587-A596 HydrophobicContact CG1-CB 3.84Å; C593-A596 WeakPolarHBondContact O-CB 3.5Å; C593-A596 PolarHBondContact O-N 3.06Å; C593-A596 VanDerWaalsContact O-N 3.13Å; A596-I599 PolarHBondContact O-N 3.31Å; A596-I600 HydrophobicContact CB-CD1 4.45Å; A596-I600 WeakPolarHBondContact O-CB 3.2Å; A596-I600 WeakPolarHBondContact O-CD1 3.39Å; A596-I600 WeakPolarHBondContact O-CG1 3.09Å; A596-I600 PolarHBondContact O-N 2.87Å; A596-H619 HydrophobicContact CB-CB 4.39Å; A596-W626 HydrophobicContact CB-CH2 4.22Å; A596-W626 HydrophobicContact CB-CZ3 4.05Å
597	G	89.2	Confident	88.3	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-53.4	-60.9	176.7	0	0	0	0	0	113	W595 I599 I600 D601 W626	W595-G597 PolarHBondContact O-N 3.48Å; G597-I599 VanDerWaalsContact C-N 3.3Å; G597-I599 PolarHBondContact O-N 3.46Å; G597-I600 PolarHBondContact O-N 3.36Å; G597-I600 VanDerWaalsContact O-N 3.11Å; G597-D601 WeakPolarHBondContact O-CB 3.49Å; G597-D601 PolarHBondContact O-N 2.89Å; G597-W626 VanDerWaalsContact N-CH2 3.34Å
598	P	90.7	Very high	87.7	Confident	40 Å²	40	42.5 Å²	42.5	26%	0.26	23%	0.227	S	C	.	.	H	α-helix	trans	-56	-36.4	178.8	-29.3	35.4	0	0	0	115.2	L528 W595 V602	L528-P598 HydrophobicContact CD1-CB 3.67Å; L528-P598 HydrophobicContact CD2-CB 4.47Å; W595-P598 WeakPolarHBondContact O-CD 3.29Å; P598-V602 WeakPolarHBondContact O-CG2 3.34Å; P598-V602 PolarHBondContact O-N 3.21Å; P598-V602 VanDerWaalsContact O-N 3.13Å
599	I	91.5	Very high	87	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-68	-44.7	176.2	-65.4	162.9	0	0	0	110.6	M525 L528 F531 F583 I587 I592 W595 A596 G597 L603	M525-I599 HydrophobicContact CB-CD1 3.82Å; M525-I599 HydrophobicContact CB-CG1 4.46Å; M525-I599 HydrophobicContact CG-CD1 4.1Å; M525-I599 HydrophobicContact CG-CG2 4.03Å; M525-I599 WeakPolarHBondContact O-CD1 3.38Å; M525-I599 WeakPolarHBondContact O-CG1 3.4Å; L528-I599 HydrophobicContact CD2-CG1 3.85Å; F531-I599 HydrophobicContact CE1-CG2 3.7Å; F531-I599 HydrophobicContact CZ-CG2 4.04Å; F583-I599 HydrophobicContact CE2-CG2 4.35Å; F583-I599 HydrophobicContact CZ-CG2 3.92Å; I587-I599 HydrophobicContact CD1-CB 4.08Å; I587-I599 HydrophobicContact CD1-CD1 4.47Å; I587-I599 HydrophobicContact CD1-CG2 3.96Å; I587-I599 HydrophobicContact CG1-CD1 4.4Å; I592-I599 HydrophobicContact CG2-CD1 4Å; W595-I599 HydrophobicContact CB-CD1 3.72Å; W595-I599 HydrophobicContact CB-CG1 4.33Å; W595-I599 WeakPolarHBondContact O-CD1 3.36Å; W595-I599 VanDerWaalsContact O-CG1 3.23Å; W595-I599 WeakPolarHBondContact O-CG1 3.39Å; W595-I599 PolarHBondContact O-N 3.48Å; W595-I599 VanDerWaalsContact O-N 3.11Å; A596-I599 PolarHBondContact O-N 3.31Å; G597-I599 VanDerWaalsContact C-N 3.3Å; G597-I599 PolarHBondContact O-N 3.46Å; I599-L603 HydrophobicContact CG2-CD1 4.26Å; I599-L603 WeakPolarHBondContact O-CG 3.46Å; I599-L603 PolarHBondContact O-N 2.88Å
600	I	91.2	Very high	86.9	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-64.7	-43.7	177.4	-67.7	162.8	0	0	0	110.4	F545 I587 A596 G597 V602 L603 L604 L616 L620 I629	F545-I600 HydrophobicContact CE1-CG2 4.45Å; I587-I600 HydrophobicContact CD1-CD1 4.07Å; I587-I600 HydrophobicContact CD1-CG1 3.79Å; A596-I600 HydrophobicContact CB-CD1 4.45Å; A596-I600 WeakPolarHBondContact O-CB 3.2Å; A596-I600 WeakPolarHBondContact O-CD1 3.39Å; A596-I600 WeakPolarHBondContact O-CG1 3.09Å; A596-I600 PolarHBondContact O-N 2.87Å; G597-I600 PolarHBondContact O-N 3.36Å; G597-I600 VanDerWaalsContact O-N 3.11Å; I600-V602 PolarHBondContact O-N 3.24Å; I600-L603 PolarHBondContact O-N 2.72Å; I600-L603 VanDerWaalsContact O-N 3.16Å; I600-L604 HydrophobicContact CG2-CD1 3.77Å; I600-L604 HydrophobicContact CG2-CG 4.19Å; I600-L604 VanDerWaalsContact O-CG 3.28Å; I600-L604 WeakPolarHBondContact O-CG 3.4Å; I600-L604 PolarHBondContact O-N 3.36Å; I600-L616 HydrophobicContact CD1-CD2 3.99Å; I600-L620 HydrophobicContact CD1-CD2 4.16Å; I600-L620 HydrophobicContact CD1-CG 4.43Å; I600-I629 HydrophobicContact CG2-CG2 3.98Å
601	D	90.9	Very high	86.9	Confident	56 Å²	56	48 Å²	48	30%	0.299	25%	0.247	S	C	.	.	H	α-helix	trans	-58.7	-47.1	178.7	-173.5	42.1	0	0	0	111.5	G597 L604 D605 I629 K632	G597-D601 WeakPolarHBondContact O-CB 3.49Å; G597-D601 PolarHBondContact O-N 2.89Å; D601-L604 PolarHBondContact O-N 3.47Å; D601-D605 PolarHBondContact O-N 2.7Å; D601-I629 HydrophobicContact CB-CD1 3.91Å; D601-I629 HydrophobicContact CB-CG1 3.94Å; D601-I629 HydrophobicContact CB-CG2 4.04Å; D601-K632 PolarHBondContact O-NZ 3.5Å; D601-K632 WeakPolarHBondContact OD1-CD 3.42Å; D601-K632 WeakPolarHBondContact OD1-CE 3.3Å; D601-K632 IonicContact OD1-NZ 2.85Å; D601-K632 PolarHBondContact OD1-NZ 3.29Å
602	V	91.6	Very high	87.1	Confident	21 Å²	21	45.3 Å²	45.3	13%	0.127	23%	0.227	C	C	.	.	H	α-helix	trans	-59.7	-47.2	173.5	171.1	0	0	0	0	110.9	F531 K532 L535 P598 I600 L604 D605 Y606	F531-V602 HydrophobicContact CD1-CG1 4.08Å; F531-V602 HydrophobicContact CE1-CB 4.5Å; F531-V602 HydrophobicContact CE1-CG1 4.24Å; K532-V602 HydrophobicContact CB-CG1 4.4Å; L535-V602 HydrophobicContact CD1-CG1 3.73Å; P598-V602 WeakPolarHBondContact O-CG2 3.34Å; P598-V602 PolarHBondContact O-N 3.21Å; P598-V602 VanDerWaalsContact O-N 3.13Å; I600-V602 PolarHBondContact O-N 3.24Å; V602-L604 VanDerWaalsContact C-N 3.28Å; V602-L604 PolarHBondContact O-N 2.75Å; V602-D605 WeakPolarHBondContact O-CB 3.42Å; V602-D605 PolarHBondContact O-N 2.72Å; V602-D605 VanDerWaalsContact O-N 3.1Å; V602-Y606 HydrophobicContact CG1-CE2 4.15Å; V602-Y606 WeakPolarHBondContact O-CD2 3.19Å; V602-Y606 WeakPolarHBondContact O-CE2 3.42Å
603	L	92.1	Very high	87.3	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.3	-36.1	178.6	-79.3	166.1	0	0	0	113.3	F531 L535 A541 C544 F545 F583 I599 I600 D605 Y606 V607	F531-L603 HydrophobicContact CE1-CD1 4.41Å; F531-L603 HydrophobicContact CE1-CD2 4.37Å; F531-L603 HydrophobicContact CE1-CG 3.92Å; F531-L603 HydrophobicContact CZ-CD1 3.97Å; F531-L603 HydrophobicContact CZ-CD2 3.74Å; F531-L603 HydrophobicContact CZ-CG 3.67Å; L535-L603 HydrophobicContact CD1-CD2 4.21Å; L535-L603 HydrophobicContact CD2-CD2 4.05Å; A541-L603 HydrophobicContact CB-CD2 3.65Å; C544-L603 HydrophobicContact CB-CD1 3.82Å; C544-L603 HydrophobicContact CB-CD2 4.32Å; F545-L603 HydrophobicContact CE2-CB 3.89Å; F545-L603 HydrophobicContact CZ-CB 3.68Å; F583-L603 HydrophobicContact CE1-CD1 3.94Å; F583-L603 HydrophobicContact CE2-CD1 3.71Å; F583-L603 HydrophobicContact CZ-CD1 3.26Å; I599-L603 HydrophobicContact CG2-CD1 4.26Å; I599-L603 WeakPolarHBondContact O-CG 3.46Å; I599-L603 PolarHBondContact O-N 2.88Å; I600-L603 PolarHBondContact O-N 2.72Å; I600-L603 VanDerWaalsContact O-N 3.16Å; L603-D605 PolarHBondContact O-N 3.19Å; L603-Y606 PolarHBondContact O-N 2.81Å; L603-V607 PolarHBondContact O-N 3.26Å
604	L	90.6	Very high	87.4	Confident	13 Å²	13	44.4 Å²	44.4	7%	0.068	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-11.7	177.2	-71.6	169.9	0	0	0	113.8	F545 I600 D601 V602 V607 V610 I629 K632 A633	F545-L604 HydrophobicContact CE1-CD2 4.15Å; F545-L604 HydrophobicContact CZ-CD2 3.88Å; F545-L604 HydrophobicContact CZ-CG 4.1Å; I600-L604 HydrophobicContact CG2-CD1 3.77Å; I600-L604 HydrophobicContact CG2-CG 4.19Å; I600-L604 VanDerWaalsContact O-CG 3.28Å; I600-L604 WeakPolarHBondContact O-CG 3.4Å; I600-L604 PolarHBondContact O-N 3.36Å; D601-L604 PolarHBondContact O-N 3.47Å; V602-L604 VanDerWaalsContact C-N 3.28Å; V602-L604 PolarHBondContact O-N 2.75Å; L604-V607 HydrophobicContact CD2-CG2 4.11Å; L604-V610 HydrophobicContact CD2-CG2 3.55Å; L604-I629 HydrophobicContact CD1-CG2 3.8Å; L604-K632 HydrophobicContact CB-CD 3.9Å; L604-K632 HydrophobicContact CB-CG 4.27Å; L604-K632 HydrophobicContact CD1-CB 4.41Å; L604-K632 HydrophobicContact CD1-CD 4.29Å; L604-K632 HydrophobicContact CD1-CG 4.42Å; L604-A633 HydrophobicContact CD1-CB 3.95Å; L604-A633 HydrophobicContact CD2-CB 3.97Å
605	D	90	Very high	87.5	Confident	83 Å²	83	36.1 Å²	36.1	44%	0.444	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-17.2	169.1	-68.4	-41.2	0	0	0	113	D601 V602 L603 K632	D601-D605 PolarHBondContact O-N 2.7Å; V602-D605 WeakPolarHBondContact O-CB 3.42Å; V602-D605 PolarHBondContact O-N 2.72Å; V602-D605 VanDerWaalsContact O-N 3.1Å; L603-D605 PolarHBondContact O-N 3.19Å; D605-K632 WeakPolarHBondContact OD1-CE 3.28Å; D605-K632 IonicContact OD1-NZ 2.78Å; D605-K632 PolarHBondContact OD1-NZ 3.46Å; D605-K632 IonicContact OD2-NZ 2.67Å; D605-K632 PolarHBondContact OD2-NZ 3.13Å
606	Y	89.3	Confident	87.6	Confident	69 Å²	69	30.3 Å²	30.3	27%	0.271	17%	0.169	S	C	.	.	S	Bend	trans	-112.4	7.6	-176.1	-57.8	-96.4	0	0	0	113.4	K532 L535 D536 V602 L603	K532-Y606 WeakPolarHBondContact CG-OH 3.36Å; K532-Y606 PolarHBondContact NZ-OH 2.98Å; L535-Y606 HydrophobicContact CB-CD1 3.9Å; L535-Y606 HydrophobicContact CB-CD2 4.01Å; L535-Y606 HydrophobicContact CB-CE1 3.75Å; L535-Y606 HydrophobicContact CB-CE2 3.9Å; L535-Y606 HydrophobicContact CB-CG 4.03Å; L535-Y606 HydrophobicContact CD1-CD2 3.87Å; L535-Y606 HydrophobicContact CD1-CE2 3.92Å; L535-Y606 HydrophobicContact CG-CD2 4.39Å; D536-Y606 VanDerWaalsContact OD1-CE1 3.31Å; D536-Y606 WeakPolarHBondContact OD1-CE1 3.43Å; D536-Y606 VanDerWaalsContact OD1-CZ 3.32Å; D536-Y606 PolarHBondContact OD1-OH 3.36Å; V602-Y606 HydrophobicContact CG1-CE2 4.15Å; V602-Y606 WeakPolarHBondContact O-CD2 3.19Å; V602-Y606 WeakPolarHBondContact O-CE2 3.42Å; L603-Y606 PolarHBondContact O-N 2.81Å
607	V	85.6	Confident	87.5	Confident	25 Å²	25	33.4 Å²	33.4	15%	0.152	18%	0.184	C	C	.	.			trans	-127.9	152.8	172.3	-61.9	0	0	0	0	110.6	A541 L542 F545 L603 L604 V610	A541-V607 HydrophobicContact CB-CG1 3.59Å; L542-V607 HydrophobicContact CB-CG1 4.27Å; F545-V607 HydrophobicContact CD2-CG1 4.09Å; F545-V607 HydrophobicContact CD2-CG2 4.13Å; F545-V607 HydrophobicContact CE2-CB 4.4Å; F545-V607 HydrophobicContact CE2-CG1 3.92Å; F545-V607 HydrophobicContact CE2-CG2 3.6Å; F545-V607 HydrophobicContact CZ-CG2 4.24Å; L603-V607 PolarHBondContact O-N 3.26Å; L604-V607 HydrophobicContact CD2-CG2 4.11Å; V607-V610 HydrophobicContact CB-CG1 3.88Å; V607-V610 HydrophobicContact CG1-CG1 4.41Å; V607-V610 HydrophobicContact CG2-CB 4.43Å; V607-V610 HydrophobicContact CG2-CG1 3.75Å; V607-V610 HydrophobicContact CG2-CG2 3.75Å
608	G	75.6	Confident	87.3	Confident	32 Å²	32	38.3 Å²	38.3	33%	0.33	21%	0.207	S	C	.	.	S	Bend	trans	-78.7	-139.2	166.9	0	0	0	0	0	111.2	V610	G608-V610 PolarHBondContact O-N 3.34Å
609	H	75.6	Confident	87	Confident	124 Å²	124	37.9 Å²	37.9	57%	0.574	20%	0.201	S	C	*	.	S	Bend	trans	-62.4	118.5	176.1	174.7	-82.2	0	0	0	112.1
610	V	83.8	Confident	86.8	Confident	11 Å²	11	38 Å²	38	7%	0.067	20%	0.202	C	C	.	.			trans	-131.5	135.4	174.6	-68.5	0	0	0	0	111.3	L542 F545 L604 V607 G608	L542-V610 HydrophobicContact CD1-CG1 3.81Å; F545-V610 HydrophobicContact CB-CB 4.08Å; F545-V610 HydrophobicContact CB-CG1 4.19Å; F545-V610 HydrophobicContact CD1-CB 4.39Å; F545-V610 HydrophobicContact CD1-CG2 3.98Å; F545-V610 HydrophobicContact CD2-CB 4.27Å; F545-V610 HydrophobicContact CD2-CG1 3.99Å; F545-V610 HydrophobicContact CD2-CG2 4.11Å; F545-V610 HydrophobicContact CE1-CG2 4.15Å; F545-V610 HydrophobicContact CE2-CG2 4.27Å; F545-V610 HydrophobicContact CG-CB 3.99Å; F545-V610 HydrophobicContact CG-CG1 4.14Å; F545-V610 HydrophobicContact CG-CG2 3.94Å; F545-V610 HydrophobicContact CZ-CG2 4.28Å; L604-V610 HydrophobicContact CD2-CG2 3.55Å; V607-V610 HydrophobicContact CB-CG1 3.88Å; V607-V610 HydrophobicContact CG1-CG1 4.41Å; V607-V610 HydrophobicContact CG2-CB 4.43Å; V607-V610 HydrophobicContact CG2-CG1 3.75Å; V607-V610 HydrophobicContact CG2-CG2 3.75Å; G608-V610 PolarHBondContact O-N 3.34Å
611	T	83.1	Confident	86.5	Confident	105 Å²	105	42.6 Å²	42.6	64%	0.644	23%	0.226	S	C	*	.			trans	-86.7	111.9	175.2	53.3	0	0	0	0	110.2
612	L	86.6	Confident	86.2	Confident	21 Å²	21	43.8 Å²	43.8	11%	0.11	24%	0.239	C	C	.	.			trans	-65.9	137.8	174.7	-58.4	-175.4	0	0	0	110.9	F545 L616 M617 L620 A633	F545-L612 HydrophobicContact CD1-CD2 3.64Å; F545-L612 HydrophobicContact CE1-CD2 3.6Å; L612-L616 HydrophobicContact CB-CB 4.33Å; L612-L616 HydrophobicContact CD2-CD1 4.32Å; L612-M617 HydrophobicContact CB-CG 3.81Å; L612-M617 HydrophobicContact CD1-CG 4.47Å; L612-L620 HydrophobicContact CD1-CD1 3.55Å; L612-A633 HydrophobicContact CD1-CB 3.69Å; L612-A633 HydrophobicContact CD2-CB 4.34Å; L612-A633 HydrophobicContact CG-CB 3.88Å
613	C	89.9	Confident	85.7	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.014	25%	0.251	C	S	.	.			trans	-75.2	161.7	174.4	79.7	0	0	0	0	111.4	C547 G550 H554 C584 R615 L616 M617	C547-C613 HydrophobicContact CB-CB 3.61Å; G550-C613 CarbonylContact O-C 3.49Å; G550-C613 WeakPolarHBondContact O-CA 3.29Å; G550-C613 WeakPolarHBondContact O-CB 3.38Å; H554-C613 PolarHBondContact NE2-SG 3.11Å; C584-C613 VanDerWaalsContact CB-SG 3.56Å; C613-R615 VanDerWaalsContact C-N 3.27Å; C613-R615 PolarHBondContact O-N 2.93Å; C613-L616 PolarHBondContact O-N 2.79Å; C613-M617 PolarHBondContact O-N 3.09Å; C613-M617 VanDerWaalsContact O-N 3.07Å
614	S	87.9	Confident	85	Confident	14 Å²	14	53 Å²	53	10%	0.098	29%	0.29	C	S	.	.	H	α-helix	trans	-52.2	-46.2	-175.5	87.5	0	0	0	0	112	G550 Q552 H554 L616 M617 E618	G550-S614 PolarHBondContact O-N 2.94Å; Q552-S614 PolarHBondContact O-OG 3Å; H554-S614 PolarHBondContact ND1-OG 3.36Å; S614-L616 PolarHBondContact O-N 3.15Å; S614-M617 CarbonylContact O-C 3.6Å; S614-M617 WeakPolarHBondContact O-CA 3.43Å; S614-M617 WeakPolarHBondContact O-CB 3.49Å; S614-M617 PolarHBondContact O-N 3.07Å; S614-M617 VanDerWaalsContact O-N 3.09Å; S614-E618 VanDerWaalsContact O-CG 3.3Å; S614-E618 WeakPolarHBondContact O-CG 3.38Å; S614-E618 PolarHBondContact O-N 3.11Å; S614-E618 PolarHBondContact OG-OE1 3Å
615	R	88.3	Confident	84.4	Confident	19 Å²	19	55.6 Å²	55.6	7%	0.072	32%	0.32	C	S	.	.	H	α-helix	trans	-59.1	-38.6	177.8	175	165.4	-72.2	172.5	-3.7	114.1	H554 P555 C584 S588 C613 H619	H554-R615 VanDerWaalsContact CB-NH2 3.27Å; P555-R615 PolarHBondContact O-NH2 3.29Å; C584-R615 HydrophobicContact CB-CG 4.45Å; C584-R615 WeakPolarHBondContact O-CD 3.18Å; S588-R615 VanDerWaalsContact OG-CD 3.27Å; S588-R615 WeakPolarHBondContact OG-CD 3.46Å; S588-R615 WeakPolarHBondContact OG-CG 3.47Å; C613-R615 VanDerWaalsContact C-N 3.27Å; C613-R615 PolarHBondContact O-N 2.93Å; R615-H619 PolarHBondContact O-CD2 3.13Å; R615-H619 PolarHBondContact O-N 3.41Å
616	L	88.2	Confident	84.3	Confident	2 Å²	2	53.2 Å²	53.2	1%	0.01	31%	0.305	C	S	.	.	H	α-helix	trans	-71.1	-38	175.6	-68.3	177.6	0	0	0	110.9	F545 F583 C584 I587 I600 L612 C613 S614 H619 L620	F545-L616 HydrophobicContact CD1-CD1 4.37Å; F583-L616 HydrophobicContact CE1-CD2 4.4Å; C584-L616 HydrophobicContact CB-CD1 4.39Å; C584-L616 HydrophobicContact CB-CD2 4.01Å; C584-L616 HydrophobicContact CB-CG 3.92Å; I587-L616 HydrophobicContact CG2-CD2 3.63Å; I600-L616 HydrophobicContact CD1-CD2 3.99Å; L612-L616 HydrophobicContact CB-CB 4.33Å; L612-L616 HydrophobicContact CD2-CD1 4.32Å; C613-L616 PolarHBondContact O-N 2.79Å; S614-L616 PolarHBondContact O-N 3.15Å; L616-H619 PolarHBondContact O-N 3.36Å; L616-L620 WeakPolarHBondContact O-CG 3.5Å; L616-L620 PolarHBondContact O-N 2.95Å; L616-L620 VanDerWaalsContact O-N 3.15Å
617	M	86.1	Confident	83.8	Confident	65 Å²	65	53.2 Å²	53.2	32%	0.32	32%	0.315	S	S	.	.	H	α-helix	trans	-65.3	-43.5	174.4	-65.1	-170.3	-73.3	0	0	112.1	L612 C613 S614 H619 L620 D621	L612-M617 HydrophobicContact CB-CG 3.81Å; L612-M617 HydrophobicContact CD1-CG 4.47Å; C613-M617 PolarHBondContact O-N 3.09Å; C613-M617 VanDerWaalsContact O-N 3.07Å; S614-M617 CarbonylContact O-C 3.6Å; S614-M617 WeakPolarHBondContact O-CA 3.43Å; S614-M617 WeakPolarHBondContact O-CB 3.49Å; S614-M617 PolarHBondContact O-N 3.07Å; S614-M617 VanDerWaalsContact O-N 3.09Å; M617-H619 VanDerWaalsContact C-N 3.26Å; M617-H619 PolarHBondContact O-N 3.36Å; M617-L620 PolarHBondContact O-N 3.18Å; M617-L620 VanDerWaalsContact O-N 3.11Å; M617-D621 WeakPolarHBondContact O-CB 3.3Å; M617-D621 PolarHBondContact O-N 2.96Å
618	E	85.6	Confident	83.6	Confident	103 Å²	103	55.1 Å²	55.1	48%	0.481	33%	0.333	S	S	.	.	H	α-helix	trans	-54.4	-40.6	173.9	-72.4	157.2	-141.6	0	0	111.6	S614 S622	S614-E618 VanDerWaalsContact O-CG 3.3Å; S614-E618 WeakPolarHBondContact O-CG 3.38Å; S614-E618 PolarHBondContact O-N 3.11Å; S614-E618 PolarHBondContact OG-OE1 3Å; E618-S622 WeakPolarHBondContact O-CB 3.49Å; E618-S622 PolarHBondContact O-N 2.98Å; E618-S622 PolarHBondContact O-OG 3.48Å
619	H	84.5	Confident	84	Confident	30 Å²	30	54.3 Å²	54.3	14%	0.139	32%	0.321	C	S	.	.	H	α-helix	trans	-70	-37.5	175.9	-83.5	-60.3	0	0	0	114.2	S588 A596 R615 L616 M617 S622 W626	S588-H619 WeakPolarHBondContact CA-NE2 3.15Å; S588-H619 WeakPolarHBondContact CB-NE2 3.27Å; S588-H619 PolarHBondContact OG-CD2 3.12Å; S588-H619 PolarHBondContact OG-NE2 2.95Å; A596-H619 HydrophobicContact CB-CB 4.39Å; R615-H619 PolarHBondContact O-CD2 3.13Å; R615-H619 PolarHBondContact O-N 3.41Å; L616-H619 PolarHBondContact O-N 3.36Å; M617-H619 VanDerWaalsContact C-N 3.26Å; M617-H619 PolarHBondContact O-N 3.36Å; H619-S622 PolarHBondContact O-N 3.24Å; H619-W626 WeakPolarHBondContact O-CZ3 3.46Å
620	L	85.8	Confident	84	Confident	3 Å²	3	52.2 Å²	52.2	2%	0.016	31%	0.31	C	S	.	.	H	α-helix	trans	-68.7	-38.3	174.7	-65.7	178	0	0	0	111.6	I600 L612 L616 M617 S622 Y623 W626 I629 K630	I600-L620 HydrophobicContact CD1-CD2 4.16Å; I600-L620 HydrophobicContact CD1-CG 4.43Å; L612-L620 HydrophobicContact CD1-CD1 3.55Å; L616-L620 WeakPolarHBondContact O-CG 3.5Å; L616-L620 PolarHBondContact O-N 2.95Å; L616-L620 VanDerWaalsContact O-N 3.15Å; M617-L620 PolarHBondContact O-N 3.18Å; M617-L620 VanDerWaalsContact O-N 3.11Å; L620-S622 VanDerWaalsContact C-N 3.32Å; L620-S622 PolarHBondContact O-N 3.19Å; L620-Y623 PolarHBondContact O-N 2.81Å; L620-W626 HydrophobicContact CD2-CB 4.06Å; L620-W626 HydrophobicContact CD2-CE3 4.23Å; L620-I629 HydrophobicContact CD1-CG2 4.37Å; L620-I629 HydrophobicContact CD2-CB 4.16Å; L620-I629 HydrophobicContact CD2-CG2 3.99Å; L620-K630 HydrophobicContact CD1-CB 4.37Å
621	D	84.9	Confident	83.7	Confident	96 Å²	96	57.8 Å²	57.8	51%	0.513	34%	0.336	S	S	.	.	H	α-helix	trans	-74	-22	177.8	-69.5	-24	0	0	0	112.9	M617 Y623 K630	M617-D621 WeakPolarHBondContact O-CB 3.3Å; M617-D621 PolarHBondContact O-N 2.96Å; D621-Y623 PolarHBondContact O-N 3.14Å; D621-K630 WeakPolarHBondContact OD1-CD 3.49Å; D621-K630 IonicContact OD1-NZ 3.54Å; D621-K630 PolarHBondContact OD1-NZ 3.29Å; D621-K630 IonicContact OD2-NZ 3.38Å; D621-K630 PolarHBondContact OD2-NZ 2.86Å
622	S	84.5	Confident	83.5	Confident	81 Å²	81	54.3 Å²	54.3	57%	0.566	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-16.6	175.8	-65.3	0	0	0	0	114.2	E618 H619 L620	E618-S622 WeakPolarHBondContact O-CB 3.49Å; E618-S622 PolarHBondContact O-N 2.98Å; E618-S622 PolarHBondContact O-OG 3.48Å; H619-S622 PolarHBondContact O-N 3.24Å; L620-S622 VanDerWaalsContact C-N 3.32Å; L620-S622 PolarHBondContact O-N 3.19Å
623	Y	81.5	Confident	82.9	Confident	97 Å²	97	53.9 Å²	53.9	38%	0.38	31%	0.311	S	S	.	.			trans	-133.9	110	-177.5	-71	-85.4	0	0	0	110.9	L620 D621 G625 W626	L620-Y623 PolarHBondContact O-N 2.81Å; D621-Y623 PolarHBondContact O-N 3.14Å; Y623-G625 PolarHBondContact O-N 3.22Å; Y623-W626 HydrophobicContact CD2-CD2 4.38Å; Y623-W626 AromaticContact CD2-CE3 3.71Å; Y623-W626 HydrophobicContact CD2-CE3 3.71Å; Y623-W626 AromaticContact CD2-CH2 3.59Å; Y623-W626 HydrophobicContact CD2-CH2 3.59Å; Y623-W626 HydrophobicContact CD2-CZ2 4.27Å; Y623-W626 AromaticContact CD2-CZ3 3.28Å; Y623-W626 HydrophobicContact CD2-CZ3 3.28Å; Y623-W626 AromaticContact CE2-CH2 3.9Å; Y623-W626 HydrophobicContact CE2-CH2 3.9Å; Y623-W626 AromaticContact CE2-CZ3 3.9Å; Y623-W626 HydrophobicContact CE2-CZ3 3.9Å; Y623-W626 HydrophobicContact CG-CD2 4.27Å; Y623-W626 HydrophobicContact CG-CE3 4.03Å; Y623-W626 HydrophobicContact CG-CH2 4.11Å; Y623-W626 HydrophobicContact CG-CZ2 4.34Å; Y623-W626 AromaticContact CG-CZ3 3.96Å; Y623-W626 HydrophobicContact CG-CZ3 3.96Å; Y623-W626 WeakPolarHBondContact O-CB 3.11Å; Y623-W626 PolarHBondContact O-N 3.28Å
624	S	77.1	Confident	81.6	Confident	118 Å²	118	56.3 Å²	56.3	83%	0.825	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-56.4	-25.7	-176.5	54.8	0	0	0	0	114.9	W626 S627	S624-W626 PolarHBondContact O-N 3.38Å; S624-S627 PolarHBondContact O-OG 3.16Å
625	G	78.8	Confident	80.2	Confident	67 Å²	67	60.6 Å²	60.6	69%	0.691	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-73.9	-3.2	175	0	0	0	0	0	115.5	Y623	Y623-G625 PolarHBondContact O-N 3.22Å
626	W	86.9	Confident	78.4	Confident	33 Å²	33	67.4 Å²	67.4	13%	0.125	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-107.4	5.8	-177.8	-63.8	-13.4	0	0	0	113.9	R594 A596 G597 H619 L620 Y623 S624 A628 I629 K630	R594-W626 WeakPolarHBondContact O-CZ2 3.19Å; A596-W626 HydrophobicContact CB-CH2 4.22Å; A596-W626 HydrophobicContact CB-CZ3 4.05Å; G597-W626 VanDerWaalsContact N-CH2 3.34Å; H619-W626 WeakPolarHBondContact O-CZ3 3.46Å; L620-W626 HydrophobicContact CD2-CB 4.06Å; L620-W626 HydrophobicContact CD2-CE3 4.23Å; Y623-W626 HydrophobicContact CD2-CD2 4.38Å; Y623-W626 AromaticContact CD2-CE3 3.71Å; Y623-W626 HydrophobicContact CD2-CE3 3.71Å; Y623-W626 AromaticContact CD2-CH2 3.59Å; Y623-W626 HydrophobicContact CD2-CH2 3.59Å; Y623-W626 HydrophobicContact CD2-CZ2 4.27Å; Y623-W626 AromaticContact CD2-CZ3 3.28Å; Y623-W626 HydrophobicContact CD2-CZ3 3.28Å; Y623-W626 AromaticContact CE2-CH2 3.9Å; Y623-W626 HydrophobicContact CE2-CH2 3.9Å; Y623-W626 AromaticContact CE2-CZ3 3.9Å; Y623-W626 HydrophobicContact CE2-CZ3 3.9Å; Y623-W626 HydrophobicContact CG-CD2 4.27Å; Y623-W626 HydrophobicContact CG-CE3 4.03Å; Y623-W626 HydrophobicContact CG-CH2 4.11Å; Y623-W626 HydrophobicContact CG-CZ2 4.34Å; Y623-W626 AromaticContact CG-CZ3 3.96Å; Y623-W626 HydrophobicContact CG-CZ3 3.96Å; Y623-W626 WeakPolarHBondContact O-CB 3.11Å; Y623-W626 PolarHBondContact O-N 3.28Å; S624-W626 PolarHBondContact O-N 3.38Å; W626-A628 VanDerWaalsContact C-N 3.32Å; W626-A628 PolarHBondContact O-N 3.35Å; W626-I629 HydrophobicContact CB-CD1 3.94Å; W626-I629 HydrophobicContact CG-CD1 3.96Å; W626-I629 WeakPolarHBondContact O-CB 3.33Å; W626-I629 PolarHBondContact O-N 3.45Å; W626-K630 PolarHBondContact O-N 2.99Å
627	S	79.6	Confident	76.7	Confident	70 Å²	70	75 Å²	75	49%	0.49	42%	0.419	S	S	.	.	H	α-helix	trans	-53.4	-42.9	177.7	52.4	0	0	0	0	113.6	S624 I629 K630 E631	S624-S627 PolarHBondContact O-OG 3.16Å; S627-I629 PolarHBondContact O-N 3.07Å; S627-K630 VanDerWaalsContact O-CB 3.3Å; S627-K630 WeakPolarHBondContact O-CB 3.43Å; S627-K630 PolarHBondContact O-N 3.22Å; S627-K630 VanDerWaalsContact O-N 3.07Å; S627-E631 PolarHBondContact O-N 3.49Å
628	A	82.1	Confident	74.7	Confident	64 Å²	64	77.8 Å²	77.8	53%	0.529	44%	0.442	S	S	.	.	H	α-helix	trans	-61.2	-27.8	177.1	0	0	0	0	0	113.6	W626 E631 K632	W626-A628 VanDerWaalsContact C-N 3.32Å; W626-A628 PolarHBondContact O-N 3.35Å; A628-E631 PolarHBondContact O-N 3.35Å; A628-K632 WeakPolarHBondContact O-CB 3.46Å; A628-K632 PolarHBondContact O-N 3.22Å
629	I	83.4	Confident	72.7	Confident	16 Å²	16	81 Å²	81	8%	0.082	45%	0.454	C	S	.	.	H	α-helix	trans	-73.8	-33.5	178	-54.6	167.2	0	0	0	110.1	I600 D601 L604 L620 W626 S627 K632 A633	I600-I629 HydrophobicContact CG2-CG2 3.98Å; D601-I629 HydrophobicContact CB-CD1 3.91Å; D601-I629 HydrophobicContact CB-CG1 3.94Å; D601-I629 HydrophobicContact CB-CG2 4.04Å; L604-I629 HydrophobicContact CD1-CG2 3.8Å; L620-I629 HydrophobicContact CD1-CG2 4.37Å; L620-I629 HydrophobicContact CD2-CB 4.16Å; L620-I629 HydrophobicContact CD2-CG2 3.99Å; W626-I629 HydrophobicContact CB-CD1 3.94Å; W626-I629 HydrophobicContact CG-CD1 3.96Å; W626-I629 WeakPolarHBondContact O-CB 3.33Å; W626-I629 PolarHBondContact O-N 3.45Å; S627-I629 PolarHBondContact O-N 3.07Å; I629-K632 WeakPolarHBondContact O-CB 3.47Å; I629-K632 PolarHBondContact O-N 3.11Å; I629-A633 PolarHBondContact O-N 2.68Å; I629-A633 VanDerWaalsContact O-N 3.16Å
630	K	75.4	Confident	70.6	Confident	80 Å²	80	86.5 Å²	86.5	35%	0.348	48%	0.484	S	S	.	.	H	α-helix	trans	-65.6	-42.6	173.2	-168.1	177	-173.6	171.4	0	111.3	L620 D621 W626 S627 A633 G634	L620-K630 HydrophobicContact CD1-CB 4.37Å; D621-K630 WeakPolarHBondContact OD1-CD 3.49Å; D621-K630 IonicContact OD1-NZ 3.54Å; D621-K630 PolarHBondContact OD1-NZ 3.29Å; D621-K630 IonicContact OD2-NZ 3.38Å; D621-K630 PolarHBondContact OD2-NZ 2.86Å; W626-K630 PolarHBondContact O-N 2.99Å; S627-K630 VanDerWaalsContact O-CB 3.3Å; S627-K630 WeakPolarHBondContact O-CB 3.43Å; S627-K630 PolarHBondContact O-N 3.22Å; S627-K630 VanDerWaalsContact O-N 3.07Å; K630-A633 PolarHBondContact O-N 3Å; K630-G634 PolarHBondContact O-N 3.11Å
631	E	77.5	Confident	68.1	Low	127 Å²	127	92.4 Å²	92.4	59%	0.593	52%	0.521	S	S	*	.	H	α-helix	trans	-64.6	-38.5	173.3	-65.5	-179.4	-177.7	0	0	112.3	S627 A628 A633 G634 N635	S627-E631 PolarHBondContact O-N 3.49Å; A628-E631 PolarHBondContact O-N 3.35Å; E631-A633 VanDerWaalsContact C-N 3.29Å; E631-A633 PolarHBondContact O-N 3.49Å; E631-G634 PolarHBondContact O-N 3.41Å; E631-N635 WeakPolarHBondContact O-CB 3.48Å; E631-N635 PolarHBondContact O-N 3.35Å; E631-N635 VanDerWaalsContact O-N 3.14Å; E631-N635 PolarHBondContact O-ND2 2.92Å; E631-N635 VanDerWaalsContact O-ND2 3.11Å
632	K	79.6	Confident	65.9	Low	33 Å²	33	102.2 Å²	102.2	14%	0.143	55%	0.551	C	S	.	*	H	α-helix	trans	-58.9	-38.1	175.2	-170.3	-176	-174.8	-179	0	112.4	D601 L604 D605 A628 I629	D601-K632 PolarHBondContact O-NZ 3.5Å; D601-K632 WeakPolarHBondContact OD1-CD 3.42Å; D601-K632 WeakPolarHBondContact OD1-CE 3.3Å; D601-K632 IonicContact OD1-NZ 2.85Å; D601-K632 PolarHBondContact OD1-NZ 3.29Å; L604-K632 HydrophobicContact CB-CD 3.9Å; L604-K632 HydrophobicContact CB-CG 4.27Å; L604-K632 HydrophobicContact CD1-CB 4.41Å; L604-K632 HydrophobicContact CD1-CD 4.29Å; L604-K632 HydrophobicContact CD1-CG 4.42Å; D605-K632 WeakPolarHBondContact OD1-CE 3.28Å; D605-K632 IonicContact OD1-NZ 2.78Å; D605-K632 PolarHBondContact OD1-NZ 3.46Å; D605-K632 IonicContact OD2-NZ 2.67Å; D605-K632 PolarHBondContact OD2-NZ 3.13Å; A628-K632 WeakPolarHBondContact O-CB 3.46Å; A628-K632 PolarHBondContact O-N 3.22Å; I629-K632 WeakPolarHBondContact O-CB 3.47Å; I629-K632 PolarHBondContact O-N 3.11Å
633	A	72.7	Confident	65	Low	11 Å²	11	103.3 Å²	103.3	9%	0.091	55%	0.55	C	S	.	.	H	α-helix	trans	-74.6	-29.3	177.2	0	0	0	0	0	114	L604 L612 I629 K630 E631	L604-A633 HydrophobicContact CD1-CB 3.95Å; L604-A633 HydrophobicContact CD2-CB 3.97Å; L612-A633 HydrophobicContact CD1-CB 3.69Å; L612-A633 HydrophobicContact CD2-CB 4.34Å; L612-A633 HydrophobicContact CG-CB 3.88Å; I629-A633 PolarHBondContact O-N 2.68Å; I629-A633 VanDerWaalsContact O-N 3.16Å; K630-A633 PolarHBondContact O-N 3Å; E631-A633 VanDerWaalsContact C-N 3.29Å; E631-A633 PolarHBondContact O-N 3.49Å
634	G	64.1	Low	64.1	Low	53 Å²	53	103.6 Å²	103.6	55%	0.546	56%	0.559	S	S	.	*	H	α-helix	trans	-84.9	-24.1	-178.4	0	0	0	0	0	115.1	K630 E631	K630-G634 PolarHBondContact O-N 3.11Å; E631-G634 PolarHBondContact O-N 3.41Å
635	N	58.3	Low	63.4	Low	105 Å²	105	102.8 Å²	102.8	56%	0.561	54%	0.544	S	S	*	.	S	Bend	trans	-88.2	133.1	-173	-76.5	-38.6	0	0	0	113	E631 R637	E631-N635 WeakPolarHBondContact O-CB 3.48Å; E631-N635 PolarHBondContact O-N 3.35Å; E631-N635 VanDerWaalsContact O-N 3.14Å; E631-N635 PolarHBondContact O-ND2 2.92Å; E631-N635 VanDerWaalsContact O-ND2 3.11Å; N635-R637 PolarHBondContact O-N 3.02Å
636	H	49.4	Very low	62.5	Low	162 Å²	162	104.9 Å²	104.9	75%	0.75	54%	0.535	S	S	*	.			trans	-62.6	126.6	173.6	-83.8	41.2	0	0	0	111.4
637	R	54.2	Low	61	Low	161 Å²	161	109.4 Å²	109.4	61%	0.608	56%	0.561	S	S	*	*			trans	-122.6	133.2	165	-68.4	-173.2	176.1	-169.2	-0.5	109.9	N635	N635-R637 PolarHBondContact O-N 3.02Å
638	P	43.2	Very low	59.8	Low	123 Å²	123	112.1 Å²	112.1	80%	0.799	57%	0.566	S	S	*	*			trans	-66.1	147.6	163.1	30.2	-32.8	0	0	0	109.2	L640	P638-L640 PolarHBondContact O-N 2.78Å
639	F	42.9	Very low	58.2	Low	170 Å²	170	115.5 Å²	115.5	75%	0.746	57%	0.568	S	S	*	*			trans	-56.4	137.2	179	-67.6	-88.9	0	0	0	111.4	T641	F639-T641 VanDerWaalsContact C-N 3.31Å; F639-T641 PolarHBondContact O-N 2.67Å
640	L	41.1	Very low	56.2	Low	146 Å²	146	123.2 Å²	123.2	76%	0.764	61%	0.606	S	S	*	*			trans	-70.3	94.9	156.3	-84.8	163.1	0	0	0	107.4	P638 W642	P638-L640 PolarHBondContact O-N 2.78Å; L640-W642 PolarHBondContact O-N 3.29Å
641	T	33.2	Very low	54.6	Low	127 Å²	127	126.8 Å²	126.8	78%	0.779	63%	0.627	S	S	*	*			trans	-66.8	120.4	168.9	50.4	0	0	0	0	109.2	F639	F639-T641 VanDerWaalsContact C-N 3.31Å; F639-T641 PolarHBondContact O-N 2.67Å
642	W	39.5	Very low	52.6	Low	303 Å²	303	126.7 Å²	126.7	100%	1.148	63%	0.63	S	S	*	*			trans	-103.3	0	165	-65.1	95.9	0	0	0	108.6	L640	L640-W642 PolarHBondContact O-N 3.29Å

Retrieved 642 of 642 residues in 1444.8 ms (Link to these results)

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